Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
537715 | 2ler RC | 17726 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 1 HT1 SER 1 12.003 25.661 13.093
2 H2 SER 1 HT2 SER 1 12.379 26.193 14.662
3 H3 SER 1 HT3 SER 1 11.572 24.725 14.447
4 HA SER 1 HA SER 1 14.264 25.310 13.405
5 HB2 SER 1 HB2 SER 1 13.511 23.606 15.864
6 HB3 SER 1 HB1 SER 1 15.168 23.844 15.209
7 HG SER 1 HG SER 1 15.104 25.326 16.660
8 H CYS 2 HN CYS 2 15.461 23.182 12.914
9 HA CYS 2 HA CYS 2 13.687 21.345 11.577
10 HB2 CYS 2 HB2 CYS 2 15.942 20.104 11.127
11 HB3 CYS 2 HB1 CYS 2 15.722 21.681 10.372
12 H SER 3 HN SER 3 14.391 18.890 11.885
13 HA SER 3 HA SER 3 13.294 18.289 14.371
14 HB2 SER 3 HB2 SER 3 13.684 15.820 13.526
15 HB3 SER 3 HB1 SER 3 12.677 16.880 12.491
16 HG SER 3 HG SER 3 14.324 17.093 11.115
17 H CYS 4 HN CYS 4 14.341 18.481 16.167
18 HA CYS 4 HA CYS 4 17.217 17.986 16.277
19 HB2 CYS 4 HB2 CYS 4 15.543 19.819 17.545
20 HB3 CYS 4 HB1 CYS 4 15.848 18.615 18.844
21 H LYS 5 HN LYS 5 14.166 16.532 17.294
22 HA LYS 5 HA LYS 5 15.154 14.543 18.950
23 HB2 LYS 5 HB2 LYS 5 12.680 15.060 17.252
24 HB3 LYS 5 HB1 LYS 5 12.948 13.390 17.806
25 HG2 LYS 5 HG2 LYS 5 11.437 14.646 19.247
26 HG3 LYS 5 HG1 LYS 5 12.865 13.998 20.112
27 HD2 LYS 5 HD2 LYS 5 13.922 16.210 20.171
28 HD3 LYS 5 HD1 LYS 5 12.611 16.914 19.163
29 HE2 LYS 5 HE2 LYS 5 10.956 16.579 20.984
30 HE3 LYS 5 HE1 LYS 5 12.202 15.730 21.989
31 HZ1 LYS 5 HZ1 LYS 5 13.551 17.759 21.838
32 HZ2 LYS 5 HZ2 LYS 5 12.098 18.022 22.640
33 HZ3 LYS 5 HZ3 LYS 5 12.327 18.567 21.041
34 H ARG 6 HN ARG 6 14.735 14.518 15.366
35 HA ARG 6 HA ARG 6 16.169 12.071 15.075
36 HB2 ARG 6 HB2 ARG 6 15.221 14.408 13.352
37 HB3 ARG 6 HB1 ARG 6 16.263 13.130 12.614
38 HG2 ARG 6 HG2 ARG 6 14.792 11.554 12.692
39 HG3 ARG 6 HG1 ARG 6 13.884 12.208 14.050
40 HD2 ARG 6 HD2 ARG 6 12.869 14.094 12.516
41 HD3 ARG 6 HD1 ARG 6 14.022 13.759 11.276
42 HE ARG 6 HE ARG 6 12.935 11.633 10.768
43 HH11 ARG 6 HH11 ARG 6 11.384 13.113 13.584
44 HH12 ARG 6 HH12 ARG 6 10.024 12.039 13.514
45 HH21 ARG 6 HH21 ARG 6 11.015 10.357 10.598
46 HH22 ARG 6 HH22 ARG 6 9.693 10.725 11.657
47 H ASN 7 HN ASN 7 17.094 15.085 13.554
48 HA ASN 7 HA ASN 7 19.857 14.398 14.045
49 HB2 ASN 7 HB2 ASN 7 19.027 16.769 12.304
50 HB3 ASN 7 HB1 ASN 7 20.509 15.774 12.250
51 HD21 ASN 7 HD21 ASN 7 20.336 13.528 11.526
52 HD22 ASN 7 HD22 ASN 7 19.108 13.154 10.332
53 H PHE 8 HN PHE 8 20.093 14.915 16.259
54 HA PHE 8 HA PHE 8 19.477 17.406 17.284
55 HB2 PHE 8 HB2 PHE 8 21.028 16.693 19.202
56 HB3 PHE 8 HB1 PHE 8 19.707 15.573 18.780
57 HD1 PHE 8 HD1 PHE 8 23.377 16.078 18.298
58 HD2 PHE 8 HD2 PHE 8 20.062 13.372 18.291
59 HE1 PHE 8 HE1 PHE 8 24.891 14.198 18.182
60 HE2 PHE 8 HE2 PHE 8 21.573 11.521 18.221
61 HZ PHE 8 HZ PHE 8 24.031 11.899 18.181
62 H LEU 9 HN LEU 9 22.078 16.621 15.313
63 HA LEU 9 HA LEU 9 23.671 18.899 16.120
64 HB2 LEU 9 HB2 LEU 9 24.275 17.531 13.482
65 HB3 LEU 9 HB1 LEU 9 25.279 18.407 14.647
66 HG LEU 9 HG LEU 9 24.251 15.603 15.360
67 HD11 LEU 9 HD11 LEU 9 25.397 15.475 13.173
68 HD12 LEU 9 HD12 LEU 9 26.337 14.748 14.539
69 HD13 LEU 9 HD13 LEU 9 26.814 16.366 13.883
70 HD21 LEU 9 HD21 LEU 9 25.213 16.821 17.293
71 HD22 LEU 9 HD22 LEU 9 26.712 17.158 16.298
72 HD23 LEU 9 HD23 LEU 9 26.220 15.471 16.679
73 H CYS 10 HN CYS 10 20.829 18.796 14.667
74 HA CYS 10 HA CYS 10 21.423 20.563 12.449
75 HB2 CYS 10 HB2 CYS 10 19.651 18.781 12.375
76 HB3 CYS 10 HB1 CYS 10 18.633 19.755 13.441
77 H CYS 11 HN CYS 11 20.718 20.944 15.805
78 HA CYS 11 HA CYS 11 19.349 23.436 15.385
79 HB2 CYS 11 HB2 CYS 11 19.917 21.746 17.889
80 HB3 CYS 11 HB1 CYS 11 18.816 23.132 17.890
Start of MODEL 2
1 H1 SER 1 HT1 SER 1 11.361 24.188 14.714
2 H2 SER 1 HT2 SER 1 11.390 25.032 13.262
3 H3 SER 1 HT3 SER 1 11.965 25.767 14.665
4 HA SER 1 HA SER 1 13.860 25.180 13.486
5 HB2 SER 1 HB2 SER 1 13.322 23.018 15.613
6 HB3 SER 1 HB1 SER 1 14.949 23.554 15.089
7 HG SER 1 HG SER 1 14.366 24.564 16.951
8 H CYS 2 HN CYS 2 15.343 23.198 12.808
9 HA CYS 2 HA CYS 2 13.869 21.246 11.306
10 HB2 CYS 2 HB2 CYS 2 16.149 20.037 11.248
11 HB3 CYS 2 HB1 CYS 2 16.085 21.611 10.448
12 H SER 3 HN SER 3 14.305 18.784 11.851
13 HA SER 3 HA SER 3 13.061 18.480 14.351
14 HB2 SER 3 HB2 SER 3 13.395 15.933 13.635
15 HB3 SER 3 HB1 SER 3 12.330 16.963 12.616
16 HG SER 3 HG SER 3 13.671 16.113 11.180
17 H CYS 4 HN CYS 4 14.180 18.834 16.088
18 HA CYS 4 HA CYS 4 17.024 18.531 16.157
19 HB2 CYS 4 HB2 CYS 4 15.537 20.333 17.174
20 HB3 CYS 4 HB1 CYS 4 15.135 19.185 18.491
21 H LYS 5 HN LYS 5 14.303 16.625 17.168
22 HA LYS 5 HA LYS 5 15.832 14.973 18.956
23 HB2 LYS 5 HB2 LYS 5 13.042 14.715 17.695
24 HB3 LYS 5 HB1 LYS 5 13.756 13.474 18.771
25 HG2 LYS 5 HG2 LYS 5 12.337 14.612 20.132
26 HG3 LYS 5 HG1 LYS 5 13.936 15.244 20.595
27 HD2 LYS 5 HD2 LYS 5 12.508 17.114 20.598
28 HD3 LYS 5 HD1 LYS 5 13.354 17.294 19.038
29 HE2 LYS 5 HE2 LYS 5 11.312 16.142 17.930
30 HE3 LYS 5 HE1 LYS 5 10.530 16.128 19.559
31 HZ1 LYS 5 HZ1 LYS 5 10.558 18.495 19.599
32 HZ2 LYS 5 HZ2 LYS 5 9.904 18.021 18.111
33 HZ3 LYS 5 HZ3 LYS 5 11.489 18.593 18.188
34 H ARG 6 HN ARG 6 14.738 14.725 15.547
35 HA ARG 6 HA ARG 6 15.955 12.182 15.172
36 HB2 ARG 6 HB2 ARG 6 14.819 14.439 13.469
37 HB3 ARG 6 HB1 ARG 6 15.637 13.055 12.643
38 HG2 ARG 6 HG2 ARG 6 14.125 11.585 13.105
39 HG3 ARG 6 HG1 ARG 6 13.597 12.346 14.600
40 HD2 ARG 6 HD2 ARG 6 12.286 14.188 13.254
41 HD3 ARG 6 HD1 ARG 6 13.152 13.781 11.810
42 HE ARG 6 HE ARG 6 11.792 11.827 11.487
43 HH11 ARG 6 HH11 ARG 6 11.018 12.980 14.776
44 HH12 ARG 6 HH12 ARG 6 9.473 12.306 14.723
45 HH21 ARG 6 HH21 ARG 6 9.787 10.939 11.511
46 HH22 ARG 6 HH22 ARG 6 8.730 11.137 12.886
47 H ASN 7 HN ASN 7 16.768 15.321 13.834
48 HA ASN 7 HA ASN 7 19.558 14.556 13.533
49 HB2 ASN 7 HB2 ASN 7 18.413 17.213 12.519
50 HB3 ASN 7 HB1 ASN 7 19.896 16.346 12.072
51 HD21 ASN 7 HD21 ASN 7 16.336 16.349 11.625
52 HD22 ASN 7 HD22 ASN 7 16.426 15.296 10.250
53 H PHE 8 HN PHE 8 20.348 14.669 15.719
54 HA PHE 8 HA PHE 8 19.735 16.912 17.289
55 HB2 PHE 8 HB2 PHE 8 21.216 15.923 19.006
56 HB3 PHE 8 HB1 PHE 8 20.034 14.763 18.341
57 HD1 PHE 8 HD2 PHE 8 23.655 15.640 18.359
58 HD2 PHE 8 HD1 PHE 8 20.633 12.797 17.330
59 HE1 PHE 8 HE2 PHE 8 25.337 13.930 18.088
60 HE2 PHE 8 HE1 PHE 8 22.313 11.118 17.019
61 HZ PHE 8 HZ PHE 8 24.707 11.658 17.414
62 H LEU 9 HN LEU 9 22.375 16.457 15.115
63 HA LEU 9 HA LEU 9 23.835 18.664 16.301
64 HB2 LEU 9 HB2 LEU 9 24.658 17.609 13.579
65 HB3 LEU 9 HB1 LEU 9 25.551 18.376 14.895
66 HG LEU 9 HG LEU 9 24.563 15.506 15.306
67 HD11 LEU 9 HD11 LEU 9 26.680 14.745 14.426
68 HD12 LEU 9 HD12 LEU 9 27.128 16.405 13.897
69 HD13 LEU 9 HD13 LEU 9 25.726 15.550 13.110
70 HD21 LEU 9 HD21 LEU 9 26.536 15.306 16.616
71 HD22 LEU 9 HD22 LEU 9 25.450 16.562 17.308
72 HD23 LEU 9 HD23 LEU 9 26.970 17.045 16.393
73 H CYS 10 HN CYS 10 21.094 18.767 14.899
74 HA CYS 10 HA CYS 10 21.675 20.588 12.707
75 HB2 CYS 10 HB2 CYS 10 19.909 18.841 12.545
76 HB3 CYS 10 HB1 CYS 10 18.904 19.739 13.701
77 H CYS 11 HN CYS 11 20.969 20.972 16.122
78 HA CYS 11 HA CYS 11 19.182 23.094 15.524
79 HB2 CYS 11 HB2 CYS 11 20.004 22.001 18.270
80 HB3 CYS 11 HB1 CYS 11 18.422 22.696 17.903
Start of MODEL 3
1 H1 SER 1 HT1 SER 1 11.967 25.873 13.378
2 H2 SER 1 HT2 SER 1 12.329 25.744 11.726
3 H3 SER 1 HT3 SER 1 13.087 26.895 12.667
4 HA SER 1 HA SER 1 14.656 25.209 12.408
5 HB2 SER 1 HB2 SER 1 13.334 24.859 15.156
6 HB3 SER 1 HB1 SER 1 15.006 24.365 14.762
7 HG SER 1 HG SER 1 14.618 26.438 15.782
8 H CYS 2 HN CYS 2 15.450 23.015 12.822
9 HA CYS 2 HA CYS 2 13.616 21.163 11.658
10 HB2 CYS 2 HB2 CYS 2 15.913 19.766 11.709
11 HB3 CYS 2 HB1 CYS 2 15.748 21.121 10.590
12 H SER 3 HN SER 3 13.799 18.884 12.189
13 HA SER 3 HA SER 3 12.868 18.278 14.693
14 HB2 SER 3 HB2 SER 3 13.450 15.792 13.800
15 HB3 SER 3 HB1 SER 3 12.281 16.781 12.885
16 HG SER 3 HG SER 3 15.028 16.491 12.282
17 H CYS 4 HN CYS 4 13.980 18.554 16.459
18 HA CYS 4 HA CYS 4 16.833 18.172 16.546
19 HB2 CYS 4 HB2 CYS 4 15.114 19.846 17.882
20 HB3 CYS 4 HB1 CYS 4 15.293 18.560 19.122
21 H LYS 5 HN LYS 5 13.968 16.338 17.518
22 HA LYS 5 HA LYS 5 15.312 14.444 19.074
23 HB2 LYS 5 HB2 LYS 5 12.622 14.724 17.674
24 HB3 LYS 5 HB1 LYS 5 13.156 13.061 18.022
25 HG2 LYS 5 HG2 LYS 5 11.695 13.873 19.729
26 HG3 LYS 5 HG1 LYS 5 13.304 13.435 20.371
27 HD2 LYS 5 HD2 LYS 5 13.905 15.886 20.474
28 HD3 LYS 5 HD1 LYS 5 12.256 16.288 19.882
29 HE2 LYS 5 HE2 LYS 5 11.257 15.142 21.899
30 HE3 LYS 5 HE1 LYS 5 12.918 14.725 22.472
31 HZ1 LYS 5 HZ1 LYS 5 11.790 17.464 22.123
32 HZ2 LYS 5 HZ2 LYS 5 13.394 17.135 22.507
33 HZ3 LYS 5 HZ3 LYS 5 12.165 16.667 23.571
34 H ARG 6 HN ARG 6 14.831 14.642 15.541
35 HA ARG 6 HA ARG 6 16.213 12.134 15.169
36 HB2 ARG 6 HB2 ARG 6 15.059 14.380 13.454
37 HB3 ARG 6 HB1 ARG 6 16.013 13.052 12.681
38 HG2 ARG 6 HG2 ARG 6 14.562 11.488 13.049
39 HG3 ARG 6 HG1 ARG 6 13.863 12.222 14.487
40 HD2 ARG 6 HD2 ARG 6 12.574 13.987 13.022
41 HD3 ARG 6 HD1 ARG 6 13.567 13.618 11.655
42 HE ARG 6 HE ARG 6 12.489 11.419 11.409
43 HH11 ARG 6 HH21 ARG 6 10.973 13.170 14.149
44 HH12 ARG 6 HH22 ARG 6 9.685 12.038 14.193
45 HH21 ARG 6 HH11 ARG 6 10.929 10.019 11.601
46 HH22 ARG 6 HH12 ARG 6 9.717 10.086 12.849
47 H ASN 7 HN ASN 7 16.868 15.258 13.756
48 HA ASN 7 HA ASN 7 19.604 14.578 13.436
49 HB2 ASN 7 HB2 ASN 7 18.454 17.319 12.702
50 HB3 ASN 7 HB1 ASN 7 19.858 16.482 12.020
51 HD21 ASN 7 HD21 ASN 7 19.532 14.843 10.436
52 HD22 ASN 7 HD22 ASN 7 17.966 14.611 9.695
53 H PHE 8 HN PHE 8 20.950 14.604 15.111
54 HA PHE 8 HA PHE 8 20.616 16.443 17.218
55 HB2 PHE 8 HB2 PHE 8 22.581 15.174 18.226
56 HB3 PHE 8 HB1 PHE 8 21.186 14.162 17.765
57 HD1 PHE 8 HD1 PHE 8 24.609 15.120 16.687
58 HD2 PHE 8 HD2 PHE 8 21.333 12.399 16.326
59 HE1 PHE 8 HE1 PHE 8 25.988 13.615 15.378
60 HE2 PHE 8 HE2 PHE 8 22.724 10.882 15.097
61 HZ PHE 8 HZ PHE 8 25.084 11.477 14.592
62 H LEU 9 HN LEU 9 22.513 16.762 14.399
63 HA LEU 9 HA LEU 9 24.167 18.769 15.711
64 HB2 LEU 9 HB2 LEU 9 24.265 18.475 12.698
65 HB3 LEU 9 HB1 LEU 9 25.453 18.982 13.912
66 HG LEU 9 HG LEU 9 24.696 16.017 13.729
67 HD11 LEU 9 HD11 LEU 9 26.764 17.559 12.082
68 HD12 LEU 9 HD12 LEU 9 25.277 16.720 11.449
69 HD13 LEU 9 HD13 LEU 9 26.597 15.768 12.248
70 HD21 LEU 9 HD21 LEU 9 27.235 17.453 14.656
71 HD22 LEU 9 HD22 LEU 9 26.935 15.683 14.471
72 HD23 LEU 9 HD23 LEU 9 26.004 16.586 15.712
73 H CYS 10 HN CYS 10 21.069 18.890 15.000
74 HA CYS 10 HA CYS 10 21.229 20.900 12.902
75 HB2 CYS 10 HB2 CYS 10 19.743 18.824 12.860
76 HB3 CYS 10 HB1 CYS 10 18.617 19.697 13.906
77 H CYS 11 HN CYS 11 20.521 20.985 16.372
78 HA CYS 11 HA CYS 11 18.891 23.323 15.914
79 HB2 CYS 11 HB2 CYS 11 19.555 21.719 18.423
80 HB3 CYS 11 HB1 CYS 11 18.375 23.050 18.420
Start of MODEL 4
1 H1 SER 1 HT1 SER 1 11.250 24.830 12.987
2 H2 SER 1 HT2 SER 1 11.918 26.369 13.038
3 H3 SER 1 HT3 SER 1 11.698 25.520 14.455
4 HA SER 1 HA SER 1 13.801 25.361 12.492
5 HB2 SER 1 HB2 SER 1 13.709 24.663 15.485
6 HB3 SER 1 HB1 SER 1 15.201 24.730 14.502
7 HG SER 1 HG SER 1 14.936 26.667 15.512
8 H CYS 2 HN CYS 2 15.319 23.447 12.528
9 HA CYS 2 HA CYS 2 13.840 21.252 11.609
10 HB2 CYS 2 HB2 CYS 2 16.185 20.145 11.418
11 HB3 CYS 2 HB1 CYS 2 15.890 21.571 10.434
12 H SER 3 HN SER 3 14.466 18.981 12.086
13 HA SER 3 HA SER 3 13.386 18.519 14.622
14 HB2 SER 3 HB2 SER 3 13.555 16.015 13.823
15 HB3 SER 3 HB1 SER 3 12.660 17.127 12.742
16 HG SER 3 HG SER 3 14.434 17.194 11.427
17 H CYS 4 HN CYS 4 14.489 18.668 16.401
18 HA CYS 4 HA CYS 4 17.316 18.032 16.458
19 HB2 CYS 4 HB2 CYS 4 16.028 20.021 17.582
20 HB3 CYS 4 HB1 CYS 4 15.606 18.847 18.879
21 H LYS 5 HN LYS 5 14.252 16.637 17.404
22 HA LYS 5 HA LYS 5 15.175 14.584 19.046
23 HB2 LYS 5 HB2 LYS 5 12.804 14.930 17.110
24 HB3 LYS 5 HB1 LYS 5 13.106 13.355 17.896
25 HG2 LYS 5 HG2 LYS 5 11.417 14.460 19.045
26 HG3 LYS 5 HG1 LYS 5 12.835 14.321 20.122
27 HD2 LYS 5 HD2 LYS 5 13.314 16.725 19.858
28 HD3 LYS 5 HD1 LYS 5 12.063 16.878 18.570
29 HE2 LYS 5 HE2 LYS 5 10.248 16.378 20.167
30 HE3 LYS 5 HE1 LYS 5 11.441 16.010 21.464
31 HZ1 LYS 5 HZ1 LYS 5 12.196 18.294 21.345
32 HZ2 LYS 5 HZ2 LYS 5 10.554 18.191 21.733
33 HZ3 LYS 5 HZ3 LYS 5 11.024 18.683 20.186
34 H ARG 6 HN ARG 6 14.828 14.726 15.461
35 HA ARG 6 HA ARG 6 16.037 12.142 15.131
36 HB2 ARG 6 HB2 ARG 6 15.106 14.491 13.409
37 HB3 ARG 6 HB1 ARG 6 15.918 13.065 12.645
38 HG2 ARG 6 HG2 ARG 6 14.297 11.681 12.989
39 HG3 ARG 6 HG1 ARG 6 13.627 12.491 14.390
40 HD2 ARG 6 HD2 ARG 6 12.622 14.377 12.858
41 HD3 ARG 6 HD1 ARG 6 13.606 13.900 11.526
42 HE ARG 6 HE ARG 6 11.149 12.517 12.461
43 HH11 ARG 6 HH21 ARG 6 13.984 12.220 10.269
44 HH12 ARG 6 HH22 ARG 6 13.521 10.619 9.793
45 HH21 ARG 6 HH11 ARG 6 10.542 10.489 11.632
46 HH22 ARG 6 HH12 ARG 6 11.300 9.957 10.155
47 H ASN 7 HN ASN 7 16.932 15.180 13.667
48 HA ASN 7 HA ASN 7 19.699 14.327 13.634
49 HB2 ASN 7 HB2 ASN 7 18.707 16.828 12.172
50 HB3 ASN 7 HB1 ASN 7 20.132 15.816 11.869
51 HD21 ASN 7 HD21 ASN 7 16.684 16.145 11.266
52 HD22 ASN 7 HD22 ASN 7 16.516 14.690 10.346
53 H PHE 8 HN PHE 8 20.296 14.633 15.791
54 HA PHE 8 HA PHE 8 19.733 16.935 17.193
55 HB2 PHE 8 HB2 PHE 8 21.352 15.937 18.904
56 HB3 PHE 8 HB1 PHE 8 20.040 14.866 18.353
57 HD1 PHE 8 HD2 PHE 8 23.688 15.553 17.707
58 HD2 PHE 8 HD1 PHE 8 20.431 12.779 17.583
59 HE1 PHE 8 HE2 PHE 8 25.212 13.763 17.224
60 HE2 PHE 8 HE1 PHE 8 21.968 10.997 17.154
61 HZ PHE 8 HZ PHE 8 24.400 11.449 16.952
62 H LEU 9 HN LEU 9 22.225 16.528 14.960
63 HA LEU 9 HA LEU 9 23.800 18.702 16.081
64 HB2 LEU 9 HB2 LEU 9 24.280 17.825 13.208
65 HB3 LEU 9 HB1 LEU 9 25.328 18.553 14.434
66 HG LEU 9 HG LEU 9 24.464 15.615 14.699
67 HD11 LEU 9 HD11 LEU 9 26.856 16.875 13.250
68 HD12 LEU 9 HD12 LEU 9 25.514 15.900 12.500
69 HD13 LEU 9 HD13 LEU 9 26.653 15.136 13.696
70 HD21 LEU 9 HD21 LEU 9 26.511 15.374 15.886
71 HD22 LEU 9 HD22 LEU 9 25.450 16.507 16.782
72 HD23 LEU 9 HD23 LEU 9 26.875 17.139 15.819
73 H CYS 10 HN CYS 10 20.912 18.681 14.552
74 HA CYS 10 HA CYS 10 21.472 20.713 12.607
75 HB2 CYS 10 HB2 CYS 10 19.626 18.919 12.442
76 HB3 CYS 10 HB1 CYS 10 18.681 19.909 13.551
77 H CYS 11 HN CYS 11 20.876 20.878 15.997
78 HA CYS 11 HA CYS 11 18.846 22.775 15.684
79 HB2 CYS 11 HB2 CYS 11 20.133 21.804 18.302
80 HB3 CYS 11 HB1 CYS 11 18.409 22.169 18.104
Start of MODEL 5
1 H1 SER 1 HT1 SER 1 12.450 26.361 14.138
2 H2 SER 1 HT2 SER 1 11.577 25.032 13.612
3 H3 SER 1 HT3 SER 1 12.367 25.976 12.498
4 HA SER 1 HA SER 1 14.489 25.278 13.179
5 HB2 SER 1 HB2 SER 1 13.122 23.886 15.561
6 HB3 SER 1 HB1 SER 1 14.878 23.824 15.189
7 HG SER 1 HG SER 1 14.543 25.374 16.682
8 H CYS 2 HN CYS 2 15.548 23.138 12.715
9 HA CYS 2 HA CYS 2 13.748 21.238 11.515
10 HB2 CYS 2 HB2 CYS 2 16.074 20.068 11.083
11 HB3 CYS 2 HB1 CYS 2 15.677 21.536 10.170
12 H SER 3 HN SER 3 14.004 18.905 11.976
13 HA SER 3 HA SER 3 13.314 18.553 14.601
14 HB2 SER 3 HB2 SER 3 13.540 15.939 13.866
15 HB3 SER 3 HB1 SER 3 12.243 16.973 13.211
16 HG SER 3 HG SER 3 13.086 16.052 11.543
17 H CYS 4 HN CYS 4 14.461 18.547 16.313
18 HA CYS 4 HA CYS 4 17.302 17.900 16.132
19 HB2 CYS 4 HB2 CYS 4 15.889 19.904 17.364
20 HB3 CYS 4 HB1 CYS 4 16.254 18.816 18.743
21 H LYS 5 HN LYS 5 14.381 16.377 17.315
22 HA LYS 5 HA LYS 5 15.770 14.634 19.102
23 HB2 LYS 5 HB2 LYS 5 12.998 14.635 17.767
24 HB3 LYS 5 HB1 LYS 5 13.595 13.214 18.662
25 HG2 LYS 5 HG2 LYS 5 12.133 14.488 20.019
26 HG3 LYS 5 HG1 LYS 5 13.772 14.439 20.734
27 HD2 LYS 5 HD2 LYS 5 14.158 16.797 19.929
28 HD3 LYS 5 HD1 LYS 5 12.487 16.822 19.261
29 HE2 LYS 5 HE2 LYS 5 11.578 16.458 21.587
30 HE3 LYS 5 HE1 LYS 5 13.271 16.393 22.228
31 HZ1 LYS 5 HZ1 LYS 5 11.658 18.664 21.467
32 HZ2 LYS 5 HZ2 LYS 5 13.230 18.742 20.875
33 HZ3 LYS 5 HZ3 LYS 5 12.982 18.578 22.517
34 H ARG 6 HN ARG 6 14.905 14.578 15.666
35 HA ARG 6 HA ARG 6 16.236 12.069 15.195
36 HB2 ARG 6 HB2 ARG 6 15.059 14.381 13.572
37 HB3 ARG 6 HB1 ARG 6 15.935 13.036 12.717
38 HG2 ARG 6 HG2 ARG 6 14.425 11.544 13.046
39 HG3 ARG 6 HG1 ARG 6 13.847 12.208 14.570
40 HD2 ARG 6 HD2 ARG 6 12.577 14.125 13.304
41 HD3 ARG 6 HD1 ARG 6 13.483 13.811 11.861
42 HE ARG 6 HE ARG 6 12.312 11.675 11.532
43 HH11 ARG 6 HH21 ARG 6 10.878 13.330 14.317
44 HH12 ARG 6 HH22 ARG 6 9.274 12.995 13.811
45 HH21 ARG 6 HH11 ARG 6 10.217 11.363 10.901
46 HH22 ARG 6 HH12 ARG 6 8.917 12.208 11.681
47 H ASN 7 HN ASN 7 16.882 15.003 13.460
48 HA ASN 7 HA ASN 7 19.703 14.544 13.550
49 HB2 ASN 7 HB2 ASN 7 18.466 17.069 12.314
50 HB3 ASN 7 HB1 ASN 7 19.991 16.226 11.910
51 HD21 ASN 7 HD21 ASN 7 19.830 14.000 11.040
52 HD22 ASN 7 HD22 ASN 7 18.481 13.610 10.024
53 H PHE 8 HN PHE 8 20.062 14.714 15.815
54 HA PHE 8 HA PHE 8 19.561 16.987 17.274
55 HB2 PHE 8 HB2 PHE 8 21.255 16.002 18.920
56 HB3 PHE 8 HB1 PHE 8 19.950 14.895 18.399
57 HD1 PHE 8 HD1 PHE 8 23.556 15.670 17.812
58 HD2 PHE 8 HD2 PHE 8 20.359 12.853 17.458
59 HE1 PHE 8 HE1 PHE 8 25.123 13.946 17.149
60 HE2 PHE 8 HE2 PHE 8 21.905 11.171 16.786
61 HZ PHE 8 HZ PHE 8 24.337 11.693 16.594
62 H LEU 9 HN LEU 9 22.029 16.526 15.025
63 HA LEU 9 HA LEU 9 23.600 18.752 16.014
64 HB2 LEU 9 HB2 LEU 9 24.016 17.758 13.159
65 HB3 LEU 9 HB1 LEU 9 25.096 18.520 14.337
66 HG LEU 9 HG LEU 9 24.232 15.607 14.774
67 HD11 LEU 9 HD11 LEU 9 26.598 16.708 13.192
68 HD12 LEU 9 HD12 LEU 9 25.172 15.814 12.496
69 HD13 LEU 9 HD13 LEU 9 26.287 14.992 13.671
70 HD21 LEU 9 HD21 LEU 9 26.627 17.254 15.732
71 HD22 LEU 9 HD22 LEU 9 26.389 15.470 15.855
72 HD23 LEU 9 HD23 LEU 9 25.280 16.554 16.761
73 H CYS 10 HN CYS 10 20.657 18.817 14.761
74 HA CYS 10 HA CYS 10 21.193 20.919 12.808
75 HB2 CYS 10 HB2 CYS 10 19.645 18.936 12.439
76 HB3 CYS 10 HB1 CYS 10 18.447 19.811 13.423
77 H CYS 11 HN CYS 11 20.754 20.968 16.152
78 HA CYS 11 HA CYS 11 19.071 23.321 16.099
79 HB2 CYS 11 HB2 CYS 11 20.402 21.752 18.352
80 HB3 CYS 11 HB1 CYS 11 19.664 23.329 18.658
Start of MODEL 6
1 H1 SER 1 HT1 SER 1 12.999 26.736 13.143
2 H2 SER 1 HT2 SER 1 12.072 25.721 14.110
3 H3 SER 1 HT3 SER 1 12.088 25.468 12.463
4 HA SER 1 HA SER 1 14.684 25.325 12.916
5 HB2 SER 1 HB2 SER 1 13.372 24.273 15.501
6 HB3 SER 1 HB1 SER 1 15.105 24.099 15.080
7 HG SER 1 HG SER 1 14.725 25.816 16.451
8 H CYS 2 HN CYS 2 15.674 23.139 12.649
9 HA CYS 2 HA CYS 2 13.739 21.273 11.658
10 HB2 CYS 2 HB2 CYS 2 15.968 19.868 11.295
11 HB3 CYS 2 HB1 CYS 2 15.597 21.214 10.218
12 H SER 3 HN SER 3 14.060 18.899 12.181
13 HA SER 3 HA SER 3 13.389 18.643 14.858
14 HB2 SER 3 HB2 SER 3 13.471 16.026 14.083
15 HB3 SER 3 HB1 SER 3 12.202 17.116 13.483
16 HG SER 3 HG SER 3 12.893 16.549 11.670
17 H CYS 4 HN CYS 4 14.934 19.121 16.235
18 HA CYS 4 HA CYS 4 17.580 18.035 16.052
19 HB2 CYS 4 HB2 CYS 4 16.726 20.240 17.099
20 HB3 CYS 4 HB1 CYS 4 16.425 19.244 18.569
21 H LYS 5 HN LYS 5 14.589 16.987 17.486
22 HA LYS 5 HA LYS 5 15.624 14.901 19.033
23 HB2 LYS 5 HB2 LYS 5 12.983 15.218 17.472
24 HB3 LYS 5 HB1 LYS 5 13.421 13.691 18.281
25 HG2 LYS 5 HG2 LYS 5 11.932 14.825 19.643
26 HG3 LYS 5 HG1 LYS 5 13.510 14.758 20.477
27 HD2 LYS 5 HD2 LYS 5 13.904 17.173 19.779
28 HD3 LYS 5 HD1 LYS 5 12.277 17.168 19.000
29 HE2 LYS 5 HE2 LYS 5 11.247 16.688 21.295
30 HE3 LYS 5 HE1 LYS 5 12.905 16.819 22.013
31 HZ1 LYS 5 HZ1 LYS 5 11.856 18.946 22.172
32 HZ2 LYS 5 HZ2 LYS 5 11.384 18.910 20.552
33 HZ3 LYS 5 HZ3 LYS 5 12.996 19.071 20.907
34 H ARG 6 HN ARG 6 14.998 14.928 15.432
35 HA ARG 6 HA ARG 6 15.996 12.239 15.289
36 HB2 ARG 6 HB2 ARG 6 15.164 14.438 13.331
37 HB3 ARG 6 HB1 ARG 6 15.871 12.864 12.756
38 HG2 ARG 6 HG2 ARG 6 14.137 11.639 13.370
39 HG3 ARG 6 HG1 ARG 6 13.535 12.759 14.563
40 HD2 ARG 6 HD2 ARG 6 12.795 14.435 12.731
41 HD3 ARG 6 HD1 ARG 6 13.694 13.630 11.497
42 HE ARG 6 HE ARG 6 11.024 13.017 12.239
43 HH11 ARG 6 HH21 ARG 6 13.812 10.830 11.711
44 HH12 ARG 6 HH22 ARG 6 12.890 9.844 10.688
45 HH21 ARG 6 HH11 ARG 6 10.026 11.775 10.637
46 HH22 ARG 6 HH12 ARG 6 10.822 10.398 10.009
47 H ASN 7 HN ASN 7 17.029 15.069 13.497
48 HA ASN 7 HA ASN 7 19.763 14.104 13.567
49 HB2 ASN 7 HB2 ASN 7 18.882 16.627 12.057
50 HB3 ASN 7 HB1 ASN 7 20.397 15.707 11.925
51 HD21 ASN 7 HD21 ASN 7 20.516 13.791 10.834
52 HD22 ASN 7 HD22 ASN 7 19.186 13.025 10.027
53 H PHE 8 HN PHE 8 20.801 14.394 15.431
54 HA PHE 8 HA PHE 8 20.021 16.415 17.181
55 HB2 PHE 8 HB2 PHE 8 21.883 15.457 18.662
56 HB3 PHE 8 HB1 PHE 8 20.615 14.325 18.115
57 HD1 PHE 8 HD1 PHE 8 24.103 15.419 17.185
58 HD2 PHE 8 HD2 PHE 8 21.166 12.314 17.278
59 HE1 PHE 8 HE1 PHE 8 25.732 13.839 16.379
60 HE2 PHE 8 HE2 PHE 8 22.795 10.751 16.490
61 HZ PHE 8 HZ PHE 8 25.110 11.489 15.987
62 H LEU 9 HN LEU 9 22.343 16.647 14.726
63 HA LEU 9 HA LEU 9 23.606 18.902 16.043
64 HB2 LEU 9 HB2 LEU 9 24.081 18.460 13.098
65 HB3 LEU 9 HB1 LEU 9 25.036 19.225 14.380
66 HG LEU 9 HG LEU 9 24.709 16.174 14.292
67 HD11 LEU 9 HD11 LEU 9 25.632 17.001 12.137
68 HD12 LEU 9 HD12 LEU 9 26.848 16.132 13.166
69 HD13 LEU 9 HD13 LEU 9 26.885 17.934 13.065
70 HD21 LEU 9 HD21 LEU 9 26.807 16.117 15.422
71 HD22 LEU 9 HD22 LEU 9 25.587 16.907 16.477
72 HD23 LEU 9 HD23 LEU 9 26.864 17.900 15.612
73 H CYS 10 HN CYS 10 20.691 18.486 14.635
74 HA CYS 10 HA CYS 10 20.712 20.967 13.112
75 HB2 CYS 10 HB2 CYS 10 19.738 18.649 12.392
76 HB3 CYS 10 HB1 CYS 10 18.286 19.186 13.267
77 H CYS 11 HN CYS 11 20.922 21.278 15.937
78 HA CYS 11 HA CYS 11 18.341 22.383 16.723
79 HB2 CYS 11 HB2 CYS 11 20.984 22.002 18.157
80 HB3 CYS 11 HB1 CYS 11 19.889 23.272 18.710
Start of MODEL 7
1 H1 SER 1 HT1 SER 1 11.434 25.207 12.953
2 H2 SER 1 HT2 SER 1 12.167 26.228 14.085
3 H3 SER 1 HT3 SER 1 11.611 24.708 14.556
4 HA SER 1 HA SER 1 13.833 25.304 12.715
5 HB2 SER 1 HB2 SER 1 13.800 24.012 15.511
6 HB3 SER 1 HB1 SER 1 15.270 24.151 14.499
7 HG SER 1 HG SER 1 15.076 25.791 16.007
8 H CYS 2 HN CYS 2 15.247 23.346 12.290
9 HA CYS 2 HA CYS 2 13.779 21.174 11.298
10 HB2 CYS 2 HB2 CYS 2 16.113 20.000 11.264
11 HB3 CYS 2 HB1 CYS 2 15.941 21.426 10.251
12 H SER 3 HN SER 3 13.879 18.955 11.877
13 HA SER 3 HA SER 3 13.074 18.525 14.474
14 HB2 SER 3 HB2 SER 3 13.453 15.969 13.617
15 HB3 SER 3 HB1 SER 3 12.144 16.960 12.917
16 HG SER 3 HG SER 3 13.699 15.864 11.443
17 H CYS 4 HN CYS 4 14.322 18.721 16.167
18 HA CYS 4 HA CYS 4 17.155 18.209 15.876
19 HB2 CYS 4 HB2 CYS 4 15.960 20.191 17.016
20 HB3 CYS 4 HB1 CYS 4 15.801 19.132 18.449
21 H LYS 5 HN LYS 5 14.370 16.687 17.381
22 HA LYS 5 HA LYS 5 15.736 15.020 19.161
23 HB2 LYS 5 HB2 LYS 5 13.089 14.667 17.601
24 HB3 LYS 5 HB1 LYS 5 13.678 13.494 18.810
25 HG2 LYS 5 HG2 LYS 5 12.016 14.816 19.780
26 HG3 LYS 5 HG1 LYS 5 13.568 15.154 20.605
27 HD2 LYS 5 HD2 LYS 5 13.714 17.341 19.363
28 HD3 LYS 5 HD1 LYS 5 12.197 16.930 18.490
29 HE2 LYS 5 HE2 LYS 5 10.956 16.929 20.697
30 HE3 LYS 5 HE1 LYS 5 12.494 17.373 21.537
31 HZ1 LYS 5 HZ1 LYS 5 12.586 19.398 20.309
32 HZ2 LYS 5 HZ2 LYS 5 11.084 19.276 21.022
33 HZ3 LYS 5 HZ3 LYS 5 11.213 19.011 19.371
34 H ARG 6 HN ARG 6 15.015 14.817 15.751
35 HA ARG 6 HA ARG 6 16.143 12.170 15.406
36 HB2 ARG 6 HB2 ARG 6 14.864 14.388 13.730
37 HB3 ARG 6 HB1 ARG 6 15.507 12.918 12.894
38 HG2 ARG 6 HG2 ARG 6 14.018 11.550 13.671
39 HG3 ARG 6 HG1 ARG 6 13.745 12.426 15.168
40 HD2 ARG 6 HD2 ARG 6 12.406 14.302 13.895
41 HD3 ARG 6 HD1 ARG 6 12.832 13.584 12.357
42 HE ARG 6 HE ARG 6 11.433 11.847 14.396
43 HH11 ARG 6 HH11 ARG 6 10.929 13.942 11.447
44 HH12 ARG 6 HH12 ARG 6 9.478 13.116 11.072
45 HH21 ARG 6 HH21 ARG 6 9.510 10.842 13.756
46 HH22 ARG 6 HH22 ARG 6 8.611 11.461 12.414
47 H ASN 7 HN ASN 7 16.806 15.067 13.553
48 HA ASN 7 HA ASN 7 19.590 14.523 13.452
49 HB2 ASN 7 HB2 ASN 7 18.449 17.205 12.525
50 HB3 ASN 7 HB1 ASN 7 19.803 16.244 11.872
51 HD21 ASN 7 HD21 ASN 7 16.281 16.648 11.971
52 HD22 ASN 7 HD22 ASN 7 15.926 15.490 10.726
53 H PHE 8 HN PHE 8 20.374 14.588 15.557
54 HA PHE 8 HA PHE 8 19.881 16.721 17.276
55 HB2 PHE 8 HB2 PHE 8 21.622 15.594 18.754
56 HB3 PHE 8 HB1 PHE 8 20.290 14.542 18.189
57 HD1 PHE 8 HD2 PHE 8 23.885 15.307 17.576
58 HD2 PHE 8 HD1 PHE 8 20.621 12.597 17.049
59 HE1 PHE 8 HE2 PHE 8 25.413 13.592 16.810
60 HE2 PHE 8 HE1 PHE 8 22.143 10.917 16.265
61 HZ PHE 8 HZ PHE 8 24.556 11.377 16.131
62 H LEU 9 HN LEU 9 22.310 16.490 14.876
63 HA LEU 9 HA LEU 9 23.795 18.667 16.100
64 HB2 LEU 9 HB2 LEU 9 24.344 17.954 13.213
65 HB3 LEU 9 HB1 LEU 9 25.347 18.643 14.500
66 HG LEU 9 HG LEU 9 24.586 15.670 14.555
67 HD11 LEU 9 HD11 LEU 9 25.684 16.196 12.386
68 HD12 LEU 9 HD12 LEU 9 26.749 15.271 13.523
69 HD13 LEU 9 HD13 LEU 9 27.019 17.042 13.287
70 HD21 LEU 9 HD21 LEU 9 26.986 17.109 15.756
71 HD22 LEU 9 HD22 LEU 9 26.552 15.363 15.801
72 HD23 LEU 9 HD23 LEU 9 25.535 16.537 16.712
73 H CYS 10 HN CYS 10 20.865 18.724 14.774
74 HA CYS 10 HA CYS 10 21.389 20.920 12.941
75 HB2 CYS 10 HB2 CYS 10 19.831 18.986 12.453
76 HB3 CYS 10 HB1 CYS 10 18.654 19.752 13.555
77 H CYS 11 HN CYS 11 20.821 20.817 16.270
78 HA CYS 11 HA CYS 11 19.130 23.161 16.293
79 HB2 CYS 11 HB2 CYS 11 20.480 21.508 18.493
80 HB3 CYS 11 HB1 CYS 11 19.828 23.111 18.860
Start of MODEL 8
1 H1 SER 1 HT1 SER 1 12.044 25.816 12.553
2 H2 SER 1 HT2 SER 1 12.521 26.453 14.022
3 H3 SER 1 HT3 SER 1 11.628 25.032 13.949
4 HA SER 1 HA SER 1 14.368 25.352 12.863
5 HB2 SER 1 HB2 SER 1 13.440 24.051 15.482
6 HB3 SER 1 HB1 SER 1 15.074 23.797 14.799
7 HG SER 1 HG SER 1 15.216 25.453 16.183
8 H CYS 2 HN CYS 2 15.496 23.165 12.574
9 HA CYS 2 HA CYS 2 13.717 21.166 11.508
10 HB2 CYS 2 HB2 CYS 2 15.945 19.837 11.292
11 HB3 CYS 2 HB1 CYS 2 15.791 21.300 10.301
12 H SER 3 HN SER 3 14.220 18.781 12.258
13 HA SER 3 HA SER 3 13.331 18.776 14.934
14 HB2 SER 3 HB2 SER 3 13.462 16.089 14.231
15 HB3 SER 3 HB1 SER 3 12.128 17.159 13.746
16 HG SER 3 HG SER 3 12.668 16.656 11.880
17 H CYS 4 HN CYS 4 14.564 18.811 16.600
18 HA CYS 4 HA CYS 4 17.335 18.086 16.444
19 HB2 CYS 4 HB2 CYS 4 16.125 19.984 17.748
20 HB3 CYS 4 HB1 CYS 4 15.733 18.757 18.987
21 H LYS 5 HN LYS 5 14.426 16.461 17.493
22 HA LYS 5 HA LYS 5 15.811 14.463 18.985
23 HB2 LYS 5 HB2 LYS 5 13.011 14.627 17.726
24 HB3 LYS 5 HB1 LYS 5 13.624 13.127 18.480
25 HG2 LYS 5 HG2 LYS 5 12.187 14.349 19.962
26 HG3 LYS 5 HG1 LYS 5 13.833 14.147 20.647
27 HD2 LYS 5 HD2 LYS 5 14.388 16.456 20.294
28 HD3 LYS 5 HD1 LYS 5 12.922 16.751 19.296
29 HE2 LYS 5 HE2 LYS 5 11.436 16.486 21.229
30 HE3 LYS 5 HE1 LYS 5 12.804 15.938 22.277
31 HZ1 LYS 5 HZ1 LYS 5 13.832 18.085 22.032
32 HZ2 LYS 5 HZ2 LYS 5 12.233 18.276 22.543
33 HZ3 LYS 5 HZ3 LYS 5 12.681 18.606 20.934
34 H ARG 6 HN ARG 6 14.840 14.752 15.540
35 HA ARG 6 HA ARG 6 15.957 12.196 14.903
36 HB2 ARG 6 HB2 ARG 6 14.849 14.626 13.432
37 HB3 ARG 6 HB1 ARG 6 15.604 13.271 12.492
38 HG2 ARG 6 HG2 ARG 6 14.083 11.793 12.961
39 HG3 ARG 6 HG1 ARG 6 13.577 12.520 14.470
40 HD2 ARG 6 HD2 ARG 6 12.376 14.473 13.198
41 HD3 ARG 6 HD1 ARG 6 13.082 13.974 11.685
42 HE ARG 6 HE ARG 6 11.638 11.711 12.873
43 HH11 ARG 6 HH11 ARG 6 10.824 14.779 11.106
44 HH12 ARG 6 HH12 ARG 6 9.685 13.918 10.135
45 HH21 ARG 6 HH21 ARG 6 9.963 10.848 11.743
46 HH22 ARG 6 HH22 ARG 6 9.102 11.851 10.558
47 H ASN 7 HN ASN 7 16.883 15.303 13.521
48 HA ASN 7 HA ASN 7 19.662 14.443 13.653
49 HB2 ASN 7 HB2 ASN 7 18.731 16.911 12.122
50 HB3 ASN 7 HB1 ASN 7 20.312 16.094 12.097
51 HD21 ASN 7 HD21 ASN 7 20.384 13.757 11.563
52 HD22 ASN 7 HD22 ASN 7 19.288 13.180 10.337
53 H PHE 8 HN PHE 8 20.327 14.682 15.723
54 HA PHE 8 HA PHE 8 19.729 16.972 17.242
55 HB2 PHE 8 HB2 PHE 8 21.326 15.811 18.938
56 HB3 PHE 8 HB1 PHE 8 19.847 14.947 18.435
57 HD1 PHE 8 HD2 PHE 8 23.536 15.023 17.849
58 HD2 PHE 8 HD1 PHE 8 19.849 12.884 17.467
59 HE1 PHE 8 HE2 PHE 8 24.735 13.043 17.170
60 HE2 PHE 8 HE1 PHE 8 21.046 10.932 16.792
61 HZ PHE 8 HZ PHE 8 23.518 10.971 16.613
62 H LEU 9 HN LEU 9 22.156 16.600 14.951
63 HA LEU 9 HA LEU 9 23.761 18.692 16.210
64 HB2 LEU 9 HB2 LEU 9 24.426 17.800 13.413
65 HB3 LEU 9 HB1 LEU 9 25.390 18.451 14.750
66 HG LEU 9 HG LEU 9 24.323 15.572 14.899
67 HD11 LEU 9 HD11 LEU 9 26.470 14.888 14.030
68 HD12 LEU 9 HD12 LEU 9 26.936 16.599 13.686
69 HD13 LEU 9 HD13 LEU 9 25.557 15.835 12.780
70 HD21 LEU 9 HD21 LEU 9 26.209 15.160 16.255
71 HD22 LEU 9 HD22 LEU 9 25.186 16.388 17.063
72 HD23 LEU 9 HD23 LEU 9 26.742 16.882 16.226
73 H CYS 10 HN CYS 10 20.939 18.794 14.803
74 HA CYS 10 HA CYS 10 21.483 20.692 12.655
75 HB2 CYS 10 HB2 CYS 10 19.823 18.719 12.534
76 HB3 CYS 10 HB1 CYS 10 18.736 19.680 13.551
77 H CYS 11 HN CYS 11 20.933 20.963 15.973
78 HA CYS 11 HA CYS 11 18.627 22.532 15.711
79 HB2 CYS 11 HB2 CYS 11 20.257 21.861 18.232
80 HB3 CYS 11 HB1 CYS 11 18.502 22.102 18.223
Start of MODEL 9
1 H1 SER 1 HT1 SER 1 13.589 25.686 13.021
2 H2 SER 1 HT2 SER 1 13.922 25.423 11.380
3 H3 SER 1 HT3 SER 1 14.919 26.420 12.323
4 HA SER 1 HA SER 1 16.070 24.435 12.092
5 HB2 SER 1 HB2 SER 1 14.596 24.266 14.792
6 HB3 SER 1 HB1 SER 1 16.134 23.445 14.421
7 HG SER 1 HG SER 1 16.344 25.432 15.531
8 H CYS 2 HN CYS 2 16.239 22.194 11.789
9 HA CYS 2 HA CYS 2 13.789 20.707 11.608
10 HB2 CYS 2 HB2 CYS 2 15.835 18.801 11.441
11 HB3 CYS 2 HB1 CYS 2 15.113 19.619 10.051
12 H SER 3 HN SER 3 13.682 18.507 12.758
13 HA SER 3 HA SER 3 13.652 19.213 15.473
14 HB2 SER 3 HB2 SER 3 13.372 16.379 14.353
15 HB3 SER 3 HB1 SER 3 12.707 16.987 15.902
16 HG SER 3 HG SER 3 11.523 18.513 14.393
17 H CYS 4 HN CYS 4 15.073 18.884 17.051
18 HA CYS 4 HA CYS 4 17.669 17.729 16.473
19 HB2 CYS 4 HB2 CYS 4 16.989 19.829 17.872
20 HB3 CYS 4 HB1 CYS 4 16.717 18.674 19.210
21 H LYS 5 HN LYS 5 14.746 16.647 18.069
22 HA LYS 5 HA LYS 5 15.862 14.341 19.208
23 HB2 LYS 5 HB2 LYS 5 13.087 15.173 18.241
24 HB3 LYS 5 HB1 LYS 5 13.394 13.430 18.448
25 HG2 LYS 5 HG2 LYS 5 12.348 14.358 20.382
26 HG3 LYS 5 HG1 LYS 5 13.949 13.683 20.790
27 HD2 LYS 5 HD2 LYS 5 14.902 16.009 20.798
28 HD3 LYS 5 HD1 LYS 5 13.283 16.667 20.364
29 HE2 LYS 5 HE2 LYS 5 12.329 15.858 22.525
30 HE3 LYS 5 HE1 LYS 5 13.912 15.082 22.943
31 HZ1 LYS 5 HZ1 LYS 5 14.899 17.369 22.655
32 HZ2 LYS 5 HZ2 LYS 5 13.901 17.166 23.996
33 HZ3 LYS 5 HZ3 LYS 5 13.323 17.980 22.631
34 H ARG 6 HN ARG 6 14.883 14.975 15.831
35 HA ARG 6 HA ARG 6 15.777 12.352 15.030
36 HB2 ARG 6 HB2 ARG 6 14.682 14.872 13.708
37 HB3 ARG 6 HB1 ARG 6 15.265 13.489 12.691
38 HG2 ARG 6 HG2 ARG 6 13.648 12.150 13.171
39 HG3 ARG 6 HG1 ARG 6 13.400 12.779 14.795
40 HD2 ARG 6 HD2 ARG 6 12.125 14.859 13.857
41 HD3 ARG 6 HD1 ARG 6 12.801 14.614 12.280
42 HE ARG 6 HE ARG 6 10.554 13.036 13.510
43 HH11 ARG 6 HH11 ARG 6 12.799 13.269 10.717
44 HH12 ARG 6 HH12 ARG 6 11.790 12.225 9.751
45 HH21 ARG 6 HH21 ARG 6 9.351 11.775 12.245
46 HH22 ARG 6 HH22 ARG 6 9.886 11.238 10.659
47 H ASN 7 HN ASN 7 16.648 15.322 13.426
48 HA ASN 7 HA ASN 7 19.377 14.417 13.239
49 HB2 ASN 7 HB2 ASN 7 18.412 17.022 11.976
50 HB3 ASN 7 HB1 ASN 7 19.776 15.987 11.515
51 HD21 ASN 7 HD21 ASN 7 19.404 14.146 10.196
52 HD22 ASN 7 HD22 ASN 7 17.839 13.715 9.597
53 H PHE 8 HN PHE 8 20.618 14.745 14.979
54 HA PHE 8 HA PHE 8 20.099 16.673 16.881
55 HB2 PHE 8 HB2 PHE 8 22.300 15.863 17.889
56 HB3 PHE 8 HB1 PHE 8 21.117 14.591 17.521
57 HD1 PHE 8 HD1 PHE 8 24.202 16.200 16.023
58 HD2 PHE 8 HD2 PHE 8 21.694 12.749 16.360
59 HE1 PHE 8 HE1 PHE 8 25.861 14.869 14.914
60 HE2 PHE 8 HE2 PHE 8 23.365 11.429 15.269
61 HZ PHE 8 HZ PHE 8 25.481 12.465 14.503
62 H LEU 9 HN LEU 9 21.653 17.137 14.044
63 HA LEU 9 HA LEU 9 23.455 19.217 14.972
64 HB2 LEU 9 HB2 LEU 9 22.792 18.964 11.990
65 HB3 LEU 9 HB1 LEU 9 24.220 19.547 12.850
66 HG LEU 9 HG LEU 9 23.644 16.533 12.939
67 HD11 LEU 9 HD11 LEU 9 25.096 16.322 11.007
68 HD12 LEU 9 HD12 LEU 9 25.026 18.098 10.706
69 HD13 LEU 9 HD13 LEU 9 23.511 17.097 10.572
70 HD21 LEU 9 HD21 LEU 9 26.251 18.112 13.037
71 HD22 LEU 9 HD22 LEU 9 25.965 16.330 13.052
72 HD23 LEU 9 HD23 LEU 9 25.420 17.302 14.454
73 H CYS 10 HN CYS 10 20.164 19.016 14.342
74 HA CYS 10 HA CYS 10 20.010 21.787 13.456
75 HB2 CYS 10 HB2 CYS 10 17.748 19.775 13.921
76 HB3 CYS 10 HB1 CYS 10 17.595 21.346 13.138
77 H CYS 11 HN CYS 11 20.742 21.171 16.376
78 HA CYS 11 HA CYS 11 18.339 21.974 17.740
79 HB2 CYS 11 HB2 CYS 11 21.143 21.320 18.667
80 HB3 CYS 11 HB1 CYS 11 20.255 22.491 19.643
Start of MODEL 10
1 H1 SER 1 HT1 SER 1 12.633 26.026 12.359
2 H2 SER 1 HT2 SER 1 13.390 27.003 13.500
3 H3 SER 1 HT3 SER 1 12.257 25.869 14.013
4 HA SER 1 HA SER 1 14.935 25.389 12.909
5 HB2 SER 1 HB2 SER 1 13.618 24.636 15.588
6 HB3 SER 1 HB1 SER 1 15.278 24.177 15.123
7 HG SER 1 HG SER 1 15.276 26.060 16.357
8 H CYS 2 HN CYS 2 15.678 23.176 12.650
9 HA CYS 2 HA CYS 2 13.585 21.455 11.663
10 HB2 CYS 2 HB2 CYS 2 15.638 20.044 10.945
11 HB3 CYS 2 HB1 CYS 2 15.418 21.602 10.150
12 H SER 3 HN SER 3 14.167 18.980 12.065
13 HA SER 3 HA SER 3 13.532 18.669 14.769
14 HB2 SER 3 HB2 SER 3 13.557 16.095 14.062
15 HB3 SER 3 HB1 SER 3 12.399 17.179 13.241
16 HG SER 3 HG SER 3 13.667 17.201 11.496
17 H CYS 4 HN CYS 4 14.958 18.919 16.314
18 HA CYS 4 HA CYS 4 17.651 17.839 16.000
19 HB2 CYS 4 HB2 CYS 4 16.944 20.083 17.061
20 HB3 CYS 4 HB1 CYS 4 16.561 19.124 18.524
21 H LYS 5 HN LYS 5 14.594 17.028 17.468
22 HA LYS 5 HA LYS 5 15.409 14.926 19.100
23 HB2 LYS 5 HB2 LYS 5 12.877 15.402 17.395
24 HB3 LYS 5 HB1 LYS 5 13.122 13.893 18.310
25 HG2 LYS 5 HG2 LYS 5 11.697 15.253 19.523
26 HG3 LYS 5 HG1 LYS 5 13.224 15.108 20.440
27 HD2 LYS 5 HD2 LYS 5 13.852 17.450 19.695
28 HD3 LYS 5 HD1 LYS 5 12.317 17.513 18.749
29 HE2 LYS 5 HE2 LYS 5 11.024 17.158 20.898
30 HE3 LYS 5 HE1 LYS 5 12.572 17.255 21.826
31 HZ1 LYS 5 HZ1 LYS 5 11.307 19.328 21.700
32 HZ2 LYS 5 HZ2 LYS 5 11.514 19.396 20.023
33 HZ3 LYS 5 HZ3 LYS 5 12.847 19.512 21.072
34 H ARG 6 HN ARG 6 14.868 14.960 15.533
35 HA ARG 6 HA ARG 6 15.913 12.310 15.280
36 HB2 ARG 6 HB2 ARG 6 15.126 14.612 13.471
37 HB3 ARG 6 HB1 ARG 6 15.938 13.142 12.767
38 HG2 ARG 6 HG2 ARG 6 14.341 11.771 13.183
39 HG3 ARG 6 HG1 ARG 6 13.687 12.622 14.567
40 HD2 ARG 6 HD2 ARG 6 12.508 14.379 13.009
41 HD3 ARG 6 HD1 ARG 6 13.620 13.995 11.729
42 HE ARG 6 HE ARG 6 12.604 11.818 11.390
43 HH11 ARG 6 HH11 ARG 6 10.703 13.714 13.797
44 HH12 ARG 6 HH12 ARG 6 9.300 12.709 13.565
45 HH21 ARG 6 HH21 ARG 6 10.905 10.350 11.582
46 HH22 ARG 6 HH22 ARG 6 9.503 10.735 12.431
47 H ASN 7 HN ASN 7 17.339 14.817 13.348
48 HA ASN 7 HA ASN 7 19.884 13.695 14.148
49 HB2 ASN 7 HB2 ASN 7 19.455 14.125 11.573
50 HB3 ASN 7 HB1 ASN 7 19.387 15.832 11.972
51 HD21 ASN 7 HD21 ASN 7 21.314 16.511 11.001
52 HD22 ASN 7 HD22 ASN 7 22.859 15.785 11.286
53 H PHE 8 HN PHE 8 21.227 14.377 15.506
54 HA PHE 8 HA PHE 8 20.359 16.308 17.276
55 HB2 PHE 8 HB2 PHE 8 22.495 15.658 18.533
56 HB3 PHE 8 HB1 PHE 8 21.422 14.303 18.090
57 HD1 PHE 8 HD1 PHE 8 24.585 16.009 17.014
58 HD2 PHE 8 HD2 PHE 8 22.149 12.501 16.914
59 HE1 PHE 8 HE1 PHE 8 26.384 14.771 15.982
60 HE2 PHE 8 HE2 PHE 8 23.930 11.287 15.873
61 HZ PHE 8 HZ PHE 8 26.085 12.410 15.370
62 H LEU 9 HN LEU 9 22.390 16.756 14.640
63 HA LEU 9 HA LEU 9 23.642 19.130 15.737
64 HB2 LEU 9 HB2 LEU 9 23.688 18.637 12.727
65 HB3 LEU 9 HB1 LEU 9 24.790 19.482 13.818
66 HG LEU 9 HG LEU 9 24.664 16.419 13.916
67 HD11 LEU 9 HD11 LEU 9 25.088 17.184 11.578
68 HD12 LEU 9 HD12 LEU 9 26.503 16.391 12.392
69 HD13 LEU 9 HD13 LEU 9 26.470 18.190 12.199
70 HD21 LEU 9 HD21 LEU 9 25.866 17.357 15.822
71 HD22 LEU 9 HD22 LEU 9 26.849 18.421 14.691
72 HD23 LEU 9 HD23 LEU 9 26.952 16.622 14.601
73 H CYS 10 HN CYS 10 20.690 18.435 14.506
74 HA CYS 10 HA CYS 10 20.350 20.936 13.049
75 HB2 CYS 10 HB2 CYS 10 19.476 18.457 12.418
76 HB3 CYS 10 HB1 CYS 10 18.035 19.034 13.270
77 H CYS 11 HN CYS 11 20.754 21.338 15.701
78 HA CYS 11 HA CYS 11 18.186 21.933 16.923
79 HB2 CYS 11 HB2 CYS 11 21.024 21.800 17.964
80 HB3 CYS 11 HB1 CYS 11 19.931 22.955 18.728
Start of MODEL 11
1 H1 SER 1 HT1 SER 1 12.210 26.230 13.869
2 H2 SER 1 HT2 SER 1 11.445 24.742 13.763
3 H3 SER 1 HT3 SER 1 11.897 25.542 12.356
4 HA SER 1 HA SER 1 14.158 25.241 12.725
5 HB2 SER 1 HB2 SER 1 13.386 23.929 15.410
6 HB3 SER 1 HB1 SER 1 15.048 23.981 14.726
7 HG SER 1 HG SER 1 14.772 25.588 16.198
8 H CYS 2 HN CYS 2 15.427 23.259 12.324
9 HA CYS 2 HA CYS 2 13.842 21.100 11.347
10 HB2 CYS 2 HB2 CYS 2 16.199 19.983 11.104
11 HB3 CYS 2 HB1 CYS 2 15.861 21.393 10.090
12 H SER 3 HN SER 3 14.033 18.850 12.031
13 HA SER 3 HA SER 3 13.341 18.775 14.705
14 HB2 SER 3 HB2 SER 3 13.314 16.149 14.206
15 HB3 SER 3 HB1 SER 3 12.287 17.206 13.171
16 HG SER 3 HG SER 3 14.919 16.517 12.486
17 H CYS 4 HN CYS 4 14.633 18.918 16.374
18 HA CYS 4 HA CYS 4 17.424 18.214 16.131
19 HB2 CYS 4 HB2 CYS 4 16.249 20.264 17.253
20 HB3 CYS 4 HB1 CYS 4 16.144 19.202 18.689
21 H LYS 5 HN LYS 5 14.566 16.739 17.504
22 HA LYS 5 HA LYS 5 15.967 14.928 19.176
23 HB2 LYS 5 HB2 LYS 5 13.210 14.836 17.794
24 HB3 LYS 5 HB1 LYS 5 13.868 13.408 18.632
25 HG2 LYS 5 HG2 LYS 5 12.327 14.526 20.025
26 HG3 LYS 5 HG1 LYS 5 13.964 14.511 20.753
27 HD2 LYS 5 HD2 LYS 5 14.277 16.906 20.154
28 HD3 LYS 5 HD1 LYS 5 12.662 16.924 19.360
29 HE2 LYS 5 HE2 LYS 5 11.565 16.404 21.566
30 HE3 LYS 5 HE1 LYS 5 13.196 16.369 22.360
31 HZ1 LYS 5 HZ1 LYS 5 12.126 18.477 22.634
32 HZ2 LYS 5 HZ2 LYS 5 11.962 18.696 20.961
33 HZ3 LYS 5 HZ3 LYS 5 13.505 18.664 21.679
34 H ARG 6 HN ARG 6 15.137 14.899 15.758
35 HA ARG 6 HA ARG 6 16.158 12.211 15.371
36 HB2 ARG 6 HB2 ARG 6 14.859 14.432 13.708
37 HB3 ARG 6 HB1 ARG 6 15.397 12.878 12.928
38 HG2 ARG 6 HG2 ARG 6 13.820 11.676 13.792
39 HG3 ARG 6 HG1 ARG 6 13.637 12.610 15.256
40 HD2 ARG 6 HD2 ARG 6 12.237 14.416 13.967
41 HD3 ARG 6 HD1 ARG 6 12.998 13.959 12.475
42 HE ARG 6 HE ARG 6 10.982 12.188 13.925
43 HH11 ARG 6 HH11 ARG 6 12.348 12.854 10.724
44 HH12 ARG 6 HH12 ARG 6 10.814 12.797 9.989
45 HH21 ARG 6 HH21 ARG 6 9.291 11.510 12.824
46 HH22 ARG 6 HH22 ARG 6 9.053 11.877 11.139
47 H ASN 7 HN ASN 7 16.680 15.224 13.648
48 HA ASN 7 HA ASN 7 19.437 14.567 13.095
49 HB2 ASN 7 HB2 ASN 7 18.194 17.289 12.399
50 HB3 ASN 7 HB1 ASN 7 19.616 16.473 11.702
51 HD21 ASN 7 HD21 ASN 7 16.503 17.204 10.902
52 HD22 ASN 7 HD22 ASN 7 16.036 15.774 10.049
53 H PHE 8 HN PHE 8 20.327 14.419 15.093
54 HA PHE 8 HA PHE 8 19.809 16.170 17.141
55 HB2 PHE 8 HB2 PHE 8 21.655 14.931 18.362
56 HB3 PHE 8 HB1 PHE 8 20.422 13.885 17.613
57 HD1 PHE 8 HD1 PHE 8 23.917 15.072 17.228
58 HD2 PHE 8 HD2 PHE 8 20.930 12.247 16.052
59 HE1 PHE 8 HE1 PHE 8 25.601 13.713 16.163
60 HE2 PHE 8 HE2 PHE 8 22.607 10.915 14.993
61 HZ PHE 8 HZ PHE 8 24.983 11.629 15.014
62 H LEU 9 HN LEU 9 22.148 16.520 14.713
63 HA LEU 9 HA LEU 9 23.604 18.548 16.204
64 HB2 LEU 9 HB2 LEU 9 24.003 18.312 13.192
65 HB3 LEU 9 HB1 LEU 9 25.073 18.815 14.509
66 HG LEU 9 HG LEU 9 24.384 15.838 14.229
67 HD11 LEU 9 HD11 LEU 9 26.572 17.422 12.807
68 HD12 LEU 9 HD12 LEU 9 25.158 16.597 12.018
69 HD13 LEU 9 HD13 LEU 9 26.396 15.626 12.913
70 HD21 LEU 9 HD21 LEU 9 26.806 17.315 15.389
71 HD22 LEU 9 HD22 LEU 9 26.546 15.537 15.172
72 HD23 LEU 9 HD23 LEU 9 25.501 16.419 16.332
73 H CYS 10 HN CYS 10 20.636 18.644 14.845
74 HA CYS 10 HA CYS 10 21.122 21.028 13.234
75 HB2 CYS 10 HB2 CYS 10 19.816 18.931 12.517
76 HB3 CYS 10 HB1 CYS 10 18.450 19.626 13.434
77 H CYS 11 HN CYS 11 20.967 21.100 16.370
78 HA CYS 11 HA CYS 11 18.800 23.051 16.542
79 HB2 CYS 11 HB2 CYS 11 20.767 21.939 18.568
80 HB3 CYS 11 HB1 CYS 11 19.908 23.444 18.899
Start of MODEL 12
1 H1 SER 1 HT1 SER 1 14.415 26.234 12.801
2 H2 SER 1 HT2 SER 1 13.436 25.094 13.597
3 H3 SER 1 HT3 SER 1 13.367 25.260 11.916
4 HA SER 1 HA SER 1 15.600 24.511 11.676
5 HB2 SER 1 HB2 SER 1 15.479 24.101 14.732
6 HB3 SER 1 HB1 SER 1 16.798 23.500 13.682
7 HG SER 1 HG SER 1 17.331 25.469 14.588
8 H CYS 2 HN CYS 2 16.276 22.179 11.632
9 HA CYS 2 HA CYS 2 14.056 20.480 11.513
10 HB2 CYS 2 HB2 CYS 2 16.512 18.914 11.691
11 HB3 CYS 2 HB1 CYS 2 15.515 19.186 10.249
12 H SER 3 HN SER 3 13.738 18.422 12.732
13 HA SER 3 HA SER 3 13.388 19.173 15.337
14 HB2 SER 3 HB2 SER 3 13.283 16.301 14.183
15 HB3 SER 3 HB1 SER 3 12.499 16.891 15.671
16 HG SER 3 HG SER 3 11.028 16.966 14.050
17 H CYS 4 HN CYS 4 14.442 18.811 17.308
18 HA CYS 4 HA CYS 4 17.103 17.832 17.266
19 HB2 CYS 4 HB2 CYS 4 15.097 18.767 19.385
20 HB3 CYS 4 HB1 CYS 4 16.629 17.981 19.839
21 H LYS 5 HN LYS 5 14.043 16.160 17.765
22 HA LYS 5 HA LYS 5 15.291 13.981 19.116
23 HB2 LYS 5 HB2 LYS 5 12.562 14.513 17.834
24 HB3 LYS 5 HB1 LYS 5 13.026 12.894 18.433
25 HG2 LYS 5 HG2 LYS 5 11.660 14.178 20.018
26 HG3 LYS 5 HG1 LYS 5 13.225 13.639 20.694
27 HD2 LYS 5 HD2 LYS 5 14.154 15.899 20.487
28 HD3 LYS 5 HD1 LYS 5 12.688 16.468 19.634
29 HE2 LYS 5 HE2 LYS 5 11.341 16.198 21.718
30 HE3 LYS 5 HE1 LYS 5 12.796 15.511 22.568
31 HZ1 LYS 5 HZ1 LYS 5 12.659 18.219 21.334
32 HZ2 LYS 5 HZ2 LYS 5 13.946 17.568 22.226
33 HZ3 LYS 5 HZ3 LYS 5 12.454 17.878 22.975
34 H ARG 6 HN ARG 6 14.448 14.691 15.694
35 HA ARG 6 HA ARG 6 15.903 12.405 14.791
36 HB2 ARG 6 HB2 ARG 6 14.616 14.890 13.607
37 HB3 ARG 6 HB1 ARG 6 15.599 13.780 12.548
38 HG2 ARG 6 HG2 ARG 6 14.294 12.093 12.683
39 HG3 ARG 6 HG1 ARG 6 13.551 12.517 14.216
40 HD2 ARG 6 HD2 ARG 6 12.210 14.458 13.086
41 HD3 ARG 6 HD1 ARG 6 13.089 14.278 11.602
42 HE ARG 6 HE ARG 6 12.196 11.699 11.866
43 HH11 ARG 6 HH11 ARG 6 10.261 14.671 12.319
44 HH12 ARG 6 HH12 ARG 6 8.783 13.773 12.501
45 HH21 ARG 6 HH21 ARG 6 10.203 10.792 11.299
46 HH22 ARG 6 HH22 ARG 6 8.746 11.580 11.783
47 H ASN 7 HN ASN 7 16.613 15.696 13.822
48 HA ASN 7 HA ASN 7 19.307 14.716 13.337
49 HB2 ASN 7 HB2 ASN 7 18.189 17.287 12.100
50 HB3 ASN 7 HB1 ASN 7 19.519 16.250 11.573
51 HD21 ASN 7 HD21 ASN 7 16.217 16.813 11.090
52 HD22 ASN 7 HD22 ASN 7 15.853 15.337 10.262
53 H PHE 8 HN PHE 8 20.696 15.078 14.972
54 HA PHE 8 HA PHE 8 20.211 17.064 16.867
55 HB2 PHE 8 HB2 PHE 8 22.357 16.220 17.915
56 HB3 PHE 8 HB1 PHE 8 21.130 14.979 17.599
57 HD1 PHE 8 HD1 PHE 8 24.383 16.299 16.329
58 HD2 PHE 8 HD2 PHE 8 21.539 13.117 16.362
59 HE1 PHE 8 HE1 PHE 8 26.028 14.813 15.353
60 HE2 PHE 8 HE2 PHE 8 23.186 11.637 15.429
61 HZ PHE 8 HZ PHE 8 25.459 12.466 14.897
62 H LEU 9 HN LEU 9 22.118 17.268 14.013
63 HA LEU 9 HA LEU 9 23.767 19.394 15.070
64 HB2 LEU 9 HB2 LEU 9 23.572 18.991 12.070
65 HB3 LEU 9 HB1 LEU 9 24.841 19.641 13.115
66 HG LEU 9 HG LEU 9 24.270 16.627 13.223
67 HD11 LEU 9 HD11 LEU 9 26.097 18.111 11.260
68 HD12 LEU 9 HD12 LEU 9 24.571 17.191 10.838
69 HD13 LEU 9 HD13 LEU 9 25.978 16.324 11.564
70 HD21 LEU 9 HD21 LEU 9 26.792 18.267 13.735
71 HD22 LEU 9 HD22 LEU 9 26.601 16.479 13.705
72 HD23 LEU 9 HD23 LEU 9 25.769 17.410 14.986
73 H CYS 10 HN CYS 10 20.564 19.197 14.013
74 HA CYS 10 HA CYS 10 20.540 21.931 13.056
75 HB2 CYS 10 HB2 CYS 10 18.209 19.973 13.434
76 HB3 CYS 10 HB1 CYS 10 18.061 21.623 12.851
77 H CYS 11 HN CYS 11 20.677 20.664 16.208
78 HA CYS 11 HA CYS 11 18.510 22.037 17.247
79 HB2 CYS 11 HB2 CYS 11 21.009 20.783 18.539
80 HB3 CYS 11 HB1 CYS 11 19.744 21.525 19.517
Start of MODEL 13
1 H1 SER 1 HT1 SER 1 12.754 26.254 14.753
2 H2 SER 1 HT2 SER 1 12.108 24.865 15.412
3 H3 SER 1 HT3 SER 1 11.830 25.273 13.783
4 HA SER 1 HA SER 1 14.427 25.251 13.693
5 HB2 SER 1 HB2 SER 1 13.783 23.258 15.952
6 HB3 SER 1 HB1 SER 1 15.391 23.426 15.193
7 HG SER 1 HG SER 1 15.662 25.337 16.106
8 H CYS 2 HN CYS 2 15.542 23.168 12.864
9 HA CYS 2 HA CYS 2 13.715 21.496 11.447
10 HB2 CYS 2 HB2 CYS 2 15.913 20.160 10.966
11 HB3 CYS 2 HB1 CYS 2 15.807 21.792 10.309
12 H SER 3 HN SER 3 14.536 18.905 11.722
13 HA SER 3 HA SER 3 13.181 18.295 14.096
14 HB2 SER 3 HB2 SER 3 13.753 15.826 13.308
15 HB3 SER 3 HB1 SER 3 12.811 16.855 12.191
16 HG SER 3 HG SER 3 15.594 16.369 12.091
17 H CYS 4 HN CYS 4 14.270 18.878 15.880
18 HA CYS 4 HA CYS 4 17.026 18.165 16.235
19 HB2 CYS 4 HB2 CYS 4 15.688 20.200 17.126
20 HB3 CYS 4 HB1 CYS 4 15.134 19.152 18.452
21 H LYS 5 HN LYS 5 13.948 16.699 17.214
22 HA LYS 5 HA LYS 5 15.044 14.876 19.026
23 HB2 LYS 5 HB2 LYS 5 12.576 14.912 17.198
24 HB3 LYS 5 HB1 LYS 5 13.043 13.383 17.974
25 HG2 LYS 5 HG2 LYS 5 11.332 14.411 19.225
26 HG3 LYS 5 HG1 LYS 5 12.822 14.256 20.199
27 HD2 LYS 5 HD2 LYS 5 13.290 16.718 19.812
28 HD3 LYS 5 HD1 LYS 5 11.760 16.823 18.867
29 HE2 LYS 5 HE2 LYS 5 10.470 16.098 20.930
30 HE3 LYS 5 HE1 LYS 5 12.023 16.054 21.857
31 HZ1 LYS 5 HZ1 LYS 5 10.869 18.117 22.167
32 HZ2 LYS 5 HZ2 LYS 5 10.836 18.418 20.490
33 HZ3 LYS 5 HZ3 LYS 5 12.305 18.424 21.302
34 H ARG 6 HN ARG 6 14.921 14.803 15.457
35 HA ARG 6 HA ARG 6 16.181 12.201 15.398
36 HB2 ARG 6 HB2 ARG 6 15.226 14.327 13.426
37 HB3 ARG 6 HB1 ARG 6 16.143 12.875 12.828
38 HG2 ARG 6 HG2 ARG 6 14.625 11.419 13.368
39 HG3 ARG 6 HG1 ARG 6 13.892 12.361 14.644
40 HD2 ARG 6 HD2 ARG 6 12.832 14.012 12.894
41 HD3 ARG 6 HD1 ARG 6 13.688 13.207 11.582
42 HE ARG 6 HE ARG 6 12.219 11.266 13.220
43 HH11 ARG 6 HH21 ARG 6 11.548 13.685 10.628
44 HH12 ARG 6 HH22 ARG 6 9.918 13.084 10.444
45 HH21 ARG 6 HH11 ARG 6 10.185 10.417 12.686
46 HH22 ARG 6 HH12 ARG 6 9.179 11.237 11.549
47 H ASN 7 HN ASN 7 17.147 15.071 13.645
48 HA ASN 7 HA ASN 7 19.882 14.225 13.918
49 HB2 ASN 7 HB2 ASN 7 19.091 16.703 12.314
50 HB3 ASN 7 HB1 ASN 7 20.440 15.570 12.060
51 HD21 ASN 7 HD21 ASN 7 19.903 13.345 11.287
52 HD22 ASN 7 HD22 ASN 7 18.428 13.123 10.378
53 H PHE 8 HN PHE 8 20.622 14.674 15.953
54 HA PHE 8 HA PHE 8 19.888 17.027 17.280
55 HB2 PHE 8 HB2 PHE 8 21.572 16.190 19.045
56 HB3 PHE 8 HB1 PHE 8 20.220 15.116 18.613
57 HD1 PHE 8 HD2 PHE 8 23.872 15.633 17.834
58 HD2 PHE 8 HD1 PHE 8 20.539 12.972 18.015
59 HE1 PHE 8 HE2 PHE 8 25.336 13.747 17.465
60 HE2 PHE 8 HE1 PHE 8 21.984 11.111 17.638
61 HZ PHE 8 HZ PHE 8 24.430 11.453 17.396
62 H LEU 9 HN LEU 9 22.414 16.591 15.043
63 HA LEU 9 HA LEU 9 23.848 18.893 16.084
64 HB2 LEU 9 HB2 LEU 9 24.469 17.913 13.297
65 HB3 LEU 9 HB1 LEU 9 25.436 18.734 14.536
66 HG LEU 9 HG LEU 9 24.671 15.769 14.850
67 HD11 LEU 9 HD11 LEU 9 27.148 17.001 13.544
68 HD12 LEU 9 HD12 LEU 9 25.832 16.095 12.686
69 HD13 LEU 9 HD13 LEU 9 26.835 15.260 13.937
70 HD21 LEU 9 HD21 LEU 9 25.554 16.851 16.963
71 HD22 LEU 9 HD22 LEU 9 27.047 17.310 16.010
72 HD23 LEU 9 HD23 LEU 9 26.556 15.580 16.201
73 H CYS 10 HN CYS 10 20.994 18.615 14.534
74 HA CYS 10 HA CYS 10 21.419 20.571 12.477
75 HB2 CYS 10 HB2 CYS 10 19.711 18.667 12.388
76 HB3 CYS 10 HB1 CYS 10 18.691 19.611 13.475
77 H CYS 11 HN CYS 11 20.748 20.881 15.874
78 HA CYS 11 HA CYS 11 18.654 22.667 15.374
79 HB2 CYS 11 HB2 CYS 11 19.935 21.916 18.060
80 HB3 CYS 11 HB1 CYS 11 18.218 22.303 17.853
Start of MODEL 14
1 H1 SER 1 HT1 SER 1 12.097 25.859 13.116
2 H2 SER 1 HT2 SER 1 13.001 25.818 11.697
3 H3 SER 1 HT3 SER 1 13.394 26.925 12.880
4 HA SER 1 HA SER 1 14.964 25.177 12.859
5 HB2 SER 1 HB2 SER 1 13.195 24.935 15.356
6 HB3 SER 1 HB1 SER 1 14.929 24.488 15.246
7 HG SER 1 HG SER 1 14.376 26.609 16.095
8 H CYS 2 HN CYS 2 15.618 23.091 12.735
9 HA CYS 2 HA CYS 2 13.592 21.314 11.731
10 HB2 CYS 2 HB2 CYS 2 15.863 19.959 11.249
11 HB3 CYS 2 HB1 CYS 2 15.472 21.397 10.292
12 H SER 3 HN SER 3 14.164 18.847 12.139
13 HA SER 3 HA SER 3 13.466 18.452 14.806
14 HB2 SER 3 HB2 SER 3 13.697 15.911 14.021
15 HB3 SER 3 HB1 SER 3 12.522 16.943 13.167
16 HG SER 3 HG SER 3 13.643 16.042 11.588
17 H CYS 4 HN CYS 4 14.895 18.887 16.350
18 HA CYS 4 HA CYS 4 17.634 17.940 16.101
19 HB2 CYS 4 HB2 CYS 4 16.810 20.171 17.103
20 HB3 CYS 4 HB1 CYS 4 16.476 19.231 18.589
21 H LYS 5 HN LYS 5 14.648 16.966 17.557
22 HA LYS 5 HA LYS 5 15.553 14.880 19.155
23 HB2 LYS 5 HB2 LYS 5 13.065 15.316 17.399
24 HB3 LYS 5 HB1 LYS 5 13.347 13.723 18.153
25 HG2 LYS 5 HG2 LYS 5 11.811 14.986 19.449
26 HG3 LYS 5 HG1 LYS 5 13.293 14.628 20.376
27 HD2 LYS 5 HD2 LYS 5 14.104 16.982 19.910
28 HD3 LYS 5 HD1 LYS 5 12.532 17.324 19.090
29 HE2 LYS 5 HE2 LYS 5 11.327 16.938 21.248
30 HE3 LYS 5 HE1 LYS 5 12.880 16.467 22.056
31 HZ1 LYS 5 HZ1 LYS 5 13.721 18.708 21.412
32 HZ2 LYS 5 HZ2 LYS 5 12.428 18.775 22.504
33 HZ3 LYS 5 HZ3 LYS 5 12.153 19.102 20.892
34 H ARG 6 HN ARG 6 14.974 14.870 15.606
35 HA ARG 6 HA ARG 6 16.092 12.228 15.385
36 HB2 ARG 6 HB2 ARG 6 14.948 14.364 13.533
37 HB3 ARG 6 HB1 ARG 6 15.665 12.851 12.841
38 HG2 ARG 6 HG2 ARG 6 14.123 11.514 13.565
39 HG3 ARG 6 HG1 ARG 6 13.701 12.468 14.975
40 HD2 ARG 6 HD2 ARG 6 12.417 14.217 13.476
41 HD3 ARG 6 HD1 ARG 6 13.157 13.561 12.050
42 HE ARG 6 HE ARG 6 11.882 11.492 12.285
43 HH11 ARG 6 HH21 ARG 6 10.768 13.981 14.681
44 HH12 ARG 6 HH22 ARG 6 9.489 12.904 15.203
45 HH21 ARG 6 HH11 ARG 6 10.105 10.254 13.129
46 HH22 ARG 6 HH12 ARG 6 9.119 11.014 14.354
47 H ASN 7 HN ASN 7 16.956 15.035 13.414
48 HA ASN 7 HA ASN 7 19.690 14.155 13.392
49 HB2 ASN 7 HB2 ASN 7 18.804 16.825 12.183
50 HB3 ASN 7 HB1 ASN 7 20.224 15.827 11.803
51 HD21 ASN 7 HD21 ASN 7 19.822 13.620 10.788
52 HD22 ASN 7 HD22 ASN 7 18.494 13.581 9.672
53 H PHE 8 HN PHE 8 20.780 14.362 15.248
54 HA PHE 8 HA PHE 8 20.071 16.249 17.139
55 HB2 PHE 8 HB2 PHE 8 22.025 15.219 18.442
56 HB3 PHE 8 HB1 PHE 8 20.785 14.088 17.839
57 HD1 PHE 8 HD2 PHE 8 24.228 15.342 17.058
58 HD2 PHE 8 HD1 PHE 8 21.296 12.270 16.556
59 HE1 PHE 8 HE2 PHE 8 25.884 13.906 16.048
60 HE2 PHE 8 HE1 PHE 8 22.934 10.865 15.539
61 HZ PHE 8 HZ PHE 8 25.266 11.653 15.268
62 H LEU 9 HN LEU 9 22.188 16.670 14.615
63 HA LEU 9 HA LEU 9 23.623 18.850 15.896
64 HB2 LEU 9 HB2 LEU 9 23.849 18.462 12.893
65 HB3 LEU 9 HB1 LEU 9 24.955 19.108 14.118
66 HG LEU 9 HG LEU 9 24.420 16.084 14.033
67 HD11 LEU 9 HD11 LEU 9 25.108 16.807 11.763
68 HD12 LEU 9 HD12 LEU 9 26.369 15.868 12.656
69 HD13 LEU 9 HD13 LEU 9 26.541 17.659 12.495
70 HD21 LEU 9 HD21 LEU 9 26.822 17.699 15.022
71 HD22 LEU 9 HD22 LEU 9 26.601 15.913 14.919
72 HD23 LEU 9 HD23 LEU 9 25.591 16.839 16.074
73 H CYS 10 HN CYS 10 20.656 18.550 14.641
74 HA CYS 10 HA CYS 10 20.626 21.078 13.203
75 HB2 CYS 10 HB2 CYS 10 19.650 18.768 12.443
76 HB3 CYS 10 HB1 CYS 10 18.209 19.292 13.348
77 H CYS 11 HN CYS 11 20.863 21.322 16.096
78 HA CYS 11 HA CYS 11 18.238 22.334 16.857
79 HB2 CYS 11 HB2 CYS 11 20.915 22.152 18.297
80 HB3 CYS 11 HB1 CYS 11 19.654 23.225 18.897
Start of MODEL 15
1 H1 SER 1 HT1 SER 1 12.022 25.847 14.696
2 H2 SER 1 HT2 SER 1 11.547 24.265 14.975
3 H3 SER 1 HT3 SER 1 11.384 24.914 13.440
4 HA SER 1 HA SER 1 13.892 25.161 13.444
5 HB2 SER 1 HB2 SER 1 13.571 23.323 15.886
6 HB3 SER 1 HB1 SER 1 15.129 23.654 15.073
7 HG SER 1 HG SER 1 14.849 25.012 16.811
8 H CYS 2 HN CYS 2 15.338 23.202 12.763
9 HA CYS 2 HA CYS 2 13.793 21.281 11.339
10 HB2 CYS 2 HB2 CYS 2 16.141 20.116 11.138
11 HB3 CYS 2 HB1 CYS 2 15.936 21.671 10.325
12 H SER 3 HN SER 3 14.129 18.861 11.676
13 HA SER 3 HA SER 3 13.222 18.281 14.227
14 HB2 SER 3 HB2 SER 3 13.563 15.786 13.357
15 HB3 SER 3 HB1 SER 3 12.430 16.851 12.453
16 HG SER 3 HG SER 3 13.684 16.053 10.936
17 H CYS 4 HN CYS 4 14.590 18.890 15.732
18 HA CYS 4 HA CYS 4 17.358 18.025 15.753
19 HB2 CYS 4 HB2 CYS 4 16.400 20.282 16.415
20 HB3 CYS 4 HB1 CYS 4 15.824 19.539 17.936
21 H LYS 5 HN LYS 5 14.323 17.049 17.123
22 HA LYS 5 HA LYS 5 15.356 15.268 19.059
23 HB2 LYS 5 HB2 LYS 5 12.764 15.583 17.470
24 HB3 LYS 5 HB1 LYS 5 13.059 14.020 18.282
25 HG2 LYS 5 HG2 LYS 5 11.665 15.349 19.644
26 HG3 LYS 5 HG1 LYS 5 13.224 15.065 20.460
27 HD2 LYS 5 HD2 LYS 5 13.908 17.448 19.714
28 HD3 LYS 5 HD1 LYS 5 12.210 17.668 19.170
29 HE2 LYS 5 HE2 LYS 5 11.441 17.158 21.557
30 HE3 LYS 5 HE1 LYS 5 13.177 16.955 22.027
31 HZ1 LYS 5 HZ1 LYS 5 13.408 19.324 21.055
32 HZ2 LYS 5 HZ2 LYS 5 12.751 19.110 22.581
33 HZ3 LYS 5 HZ3 LYS 5 11.728 19.418 21.289
34 H ARG 6 HN ARG 6 14.849 14.873 15.518
35 HA ARG 6 HA ARG 6 16.102 12.267 15.636
36 HB2 ARG 6 HB2 ARG 6 15.059 14.213 13.520
37 HB3 ARG 6 HB1 ARG 6 15.934 12.689 13.028
38 HG2 ARG 6 HG2 ARG 6 14.396 11.324 13.754
39 HG3 ARG 6 HG1 ARG 6 13.717 12.417 14.942
40 HD2 ARG 6 HD2 ARG 6 12.729 13.944 13.053
41 HD3 ARG 6 HD1 ARG 6 13.472 13.003 11.808
42 HE ARG 6 HE ARG 6 11.059 12.291 13.313
43 HH11 ARG 6 HH11 ARG 6 13.818 10.801 11.563
44 HH12 ARG 6 HH12 ARG 6 12.909 9.368 11.188
45 HH21 ARG 6 HH21 ARG 6 10.117 10.176 13.134
46 HH22 ARG 6 HH22 ARG 6 10.873 8.994 12.153
47 H ASN 7 HN ASN 7 16.952 14.842 13.484
48 HA ASN 7 HA ASN 7 19.743 14.249 13.754
49 HB2 ASN 7 HB2 ASN 7 18.715 16.581 12.073
50 HB3 ASN 7 HB1 ASN 7 20.188 15.614 11.875
51 HD21 ASN 7 HD21 ASN 7 19.827 13.128 11.580
52 HD22 ASN 7 HD22 ASN 7 18.501 12.699 10.543
53 H PHE 8 HN PHE 8 20.239 14.701 15.862
54 HA PHE 8 HA PHE 8 19.590 17.088 17.086
55 HB2 PHE 8 HB2 PHE 8 21.149 16.181 18.932
56 HB3 PHE 8 HB1 PHE 8 19.787 15.138 18.418
57 HD1 PHE 8 HD2 PHE 8 23.491 15.560 17.936
58 HD2 PHE 8 HD1 PHE 8 20.071 12.993 17.742
59 HE1 PHE 8 HE2 PHE 8 24.922 13.633 17.692
60 HE2 PHE 8 HE1 PHE 8 21.502 11.097 17.500
61 HZ PHE 8 HZ PHE 8 23.964 11.384 17.483
62 H LEU 9 HN LEU 9 22.153 16.587 14.982
63 HA LEU 9 HA LEU 9 23.780 18.693 16.141
64 HB2 LEU 9 HB2 LEU 9 24.370 17.732 13.332
65 HB3 LEU 9 HB1 LEU 9 25.380 18.423 14.615
66 HG LEU 9 HG LEU 9 24.318 15.559 14.931
67 HD11 LEU 9 HD11 LEU 9 26.899 16.475 13.577
68 HD12 LEU 9 HD12 LEU 9 25.458 15.757 12.729
69 HD13 LEU 9 HD13 LEU 9 26.362 14.792 13.972
70 HD21 LEU 9 HD21 LEU 9 26.268 15.207 16.211
71 HD22 LEU 9 HD22 LEU 9 25.290 16.481 17.002
72 HD23 LEU 9 HD23 LEU 9 26.802 16.929 16.072
73 H CYS 10 HN CYS 10 20.966 18.701 14.602
74 HA CYS 10 HA CYS 10 21.465 20.931 12.827
75 HB2 CYS 10 HB2 CYS 10 19.860 18.994 12.344
76 HB3 CYS 10 HB1 CYS 10 18.733 19.757 13.489
77 H CYS 11 HN CYS 11 20.931 20.788 16.155
78 HA CYS 11 HA CYS 11 19.159 23.036 16.289
79 HB2 CYS 11 HB2 CYS 11 20.670 21.391 18.390
80 HB3 CYS 11 HB1 CYS 11 20.093 23.002 18.819
Start of MODEL 16
1 H1 SER 1 HT1 SER 1 12.186 24.916 14.751
2 H2 SER 1 HT2 SER 1 11.630 25.159 13.154
3 H3 SER 1 HT3 SER 1 12.561 26.317 13.936
4 HA SER 1 HA SER 1 13.918 25.198 12.367
5 HB2 SER 1 HB2 SER 1 14.501 24.337 15.263
6 HB3 SER 1 HB1 SER 1 15.729 24.318 13.964
7 HG SER 1 HG SER 1 15.542 26.217 15.381
8 H CYS 2 HN CYS 2 15.263 23.182 11.965
9 HA CYS 2 HA CYS 2 13.738 20.991 11.341
10 HB2 CYS 2 HB2 CYS 2 16.146 19.803 11.341
11 HB3 CYS 2 HB1 CYS 2 15.837 21.047 10.151
12 H SER 3 HN SER 3 14.041 18.676 12.023
13 HA SER 3 HA SER 3 13.349 18.599 14.733
14 HB2 SER 3 HB2 SER 3 13.484 15.944 14.224
15 HB3 SER 3 HB1 SER 3 12.203 16.940 13.472
16 HG SER 3 HG SER 3 13.087 16.775 11.637
17 H CYS 4 HN CYS 4 14.712 18.866 16.297
18 HA CYS 4 HA CYS 4 17.505 18.116 16.067
19 HB2 CYS 4 HB2 CYS 4 16.449 20.263 17.033
20 HB3 CYS 4 HB1 CYS 4 16.148 19.298 18.521
21 H LYS 5 HN LYS 5 14.532 16.931 17.470
22 HA LYS 5 HA LYS 5 15.604 14.948 19.126
23 HB2 LYS 5 HB2 LYS 5 13.024 15.279 17.468
24 HB3 LYS 5 HB1 LYS 5 13.404 13.688 18.178
25 HG2 LYS 5 HG2 LYS 5 11.884 14.821 19.565
26 HG3 LYS 5 HG1 LYS 5 13.422 14.542 20.419
27 HD2 LYS 5 HD2 LYS 5 14.030 16.974 20.054
28 HD3 LYS 5 HD1 LYS 5 12.419 17.218 19.272
29 HE2 LYS 5 HE2 LYS 5 11.293 16.492 21.409
30 HE3 LYS 5 HE1 LYS 5 12.908 16.226 22.167
31 HZ1 LYS 5 HZ1 LYS 5 13.328 18.654 21.645
32 HZ2 LYS 5 HZ2 LYS 5 12.163 18.296 22.837
33 HZ3 LYS 5 HZ3 LYS 5 11.665 18.774 21.308
34 H ARG 6 HN ARG 6 15.024 14.920 15.585
35 HA ARG 6 HA ARG 6 16.067 12.237 15.394
36 HB2 ARG 6 HB2 ARG 6 14.816 14.355 13.585
37 HB3 ARG 6 HB1 ARG 6 15.456 12.807 12.887
38 HG2 ARG 6 HG2 ARG 6 14.023 11.516 13.854
39 HG3 ARG 6 HG1 ARG 6 13.653 12.559 15.203
40 HD2 ARG 6 HD2 ARG 6 12.296 14.183 13.657
41 HD3 ARG 6 HD1 ARG 6 12.852 13.376 12.227
42 HE ARG 6 HE ARG 6 10.733 12.407 14.038
43 HH11 ARG 6 HH21 ARG 6 13.013 11.302 11.500
44 HH12 ARG 6 HH22 ARG 6 12.416 9.675 11.556
45 HH21 ARG 6 HH11 ARG 6 10.288 10.181 14.290
46 HH22 ARG 6 HH12 ARG 6 10.890 9.034 13.167
47 H ASN 7 HN ASN 7 16.752 15.121 13.552
48 HA ASN 7 HA ASN 7 19.530 14.483 13.224
49 HB2 ASN 7 HB2 ASN 7 18.309 17.168 12.339
50 HB3 ASN 7 HB1 ASN 7 19.731 16.307 11.728
51 HD21 ASN 7 HD21 ASN 7 16.153 16.421 11.641
52 HD22 ASN 7 HD22 ASN 7 16.029 15.231 10.372
53 H PHE 8 HN PHE 8 20.406 14.486 15.284
54 HA PHE 8 HA PHE 8 19.761 16.485 17.111
55 HB2 PHE 8 HB2 PHE 8 21.423 15.324 18.612
56 HB3 PHE 8 HB1 PHE 8 20.194 14.251 17.891
57 HD1 PHE 8 HD1 PHE 8 23.789 15.212 17.643
58 HD2 PHE 8 HD2 PHE 8 20.714 12.413 16.625
59 HE1 PHE 8 HE1 PHE 8 25.453 13.592 17.006
60 HE2 PHE 8 HE2 PHE 8 22.378 10.845 15.920
61 HZ PHE 8 HZ PHE 8 24.789 11.386 16.138
62 H LEU 9 HN LEU 9 22.202 16.554 14.761
63 HA LEU 9 HA LEU 9 23.647 18.637 16.186
64 HB2 LEU 9 HB2 LEU 9 24.257 18.109 13.267
65 HB3 LEU 9 HB1 LEU 9 25.225 18.739 14.613
66 HG LEU 9 HG LEU 9 24.467 15.767 14.608
67 HD11 LEU 9 HD11 LEU 9 25.522 16.327 12.418
68 HD12 LEU 9 HD12 LEU 9 26.570 15.343 13.517
69 HD13 LEU 9 HD13 LEU 9 26.888 17.119 13.315
70 HD21 LEU 9 HD21 LEU 9 26.805 17.271 15.877
71 HD22 LEU 9 HD22 LEU 9 26.502 15.491 15.772
72 HD23 LEU 9 HD23 LEU 9 25.388 16.492 16.744
73 H CYS 10 HN CYS 10 20.749 18.698 14.817
74 HA CYS 10 HA CYS 10 21.194 21.026 13.129
75 HB2 CYS 10 HB2 CYS 10 19.817 18.942 12.522
76 HB3 CYS 10 HB1 CYS 10 18.516 19.654 13.518
77 H CYS 11 HN CYS 11 21.048 21.127 16.310
78 HA CYS 11 HA CYS 11 18.799 22.945 16.543
79 HB2 CYS 11 HB2 CYS 11 20.823 21.839 18.537
80 HB3 CYS 11 HB1 CYS 11 19.949 23.325 18.916
Start of MODEL 17
1 H1 SER 1 HT1 SER 1 11.731 25.591 12.767
2 H2 SER 1 HT2 SER 1 12.362 26.346 14.154
3 H3 SER 1 HT3 SER 1 11.522 24.895 14.260
4 HA SER 1 HA SER 1 14.125 25.310 12.930
5 HB2 SER 1 HB2 SER 1 13.450 23.733 15.488
6 HB3 SER 1 HB1 SER 1 15.081 23.872 14.775
7 HG SER 1 HG SER 1 14.909 25.305 16.374
8 H CYS 2 HN CYS 2 15.357 23.234 12.549
9 HA CYS 2 HA CYS 2 13.763 21.199 11.373
10 HB2 CYS 2 HB2 CYS 2 16.051 19.939 11.352
11 HB3 CYS 2 HB1 CYS 2 15.940 21.407 10.377
12 H SER 3 HN SER 3 14.086 18.842 11.991
13 HA SER 3 HA SER 3 13.106 18.506 14.572
14 HB2 SER 3 HB2 SER 3 13.438 15.952 13.843
15 HB3 SER 3 HB1 SER 3 12.305 16.965 12.897
16 HG SER 3 HG SER 3 13.632 15.994 11.461
17 H CYS 4 HN CYS 4 14.128 18.476 16.380
18 HA CYS 4 HA CYS 4 17.025 18.325 16.370
19 HB2 CYS 4 HB2 CYS 4 15.282 20.015 17.596
20 HB3 CYS 4 HB1 CYS 4 15.468 18.820 18.927
21 H LYS 5 HN LYS 5 14.217 16.483 17.527
22 HA LYS 5 HA LYS 5 15.658 14.696 19.141
23 HB2 LYS 5 HB2 LYS 5 12.922 14.774 17.767
24 HB3 LYS 5 HB1 LYS 5 13.524 13.216 18.401
25 HG2 LYS 5 HG2 LYS 5 12.029 14.267 19.949
26 HG3 LYS 5 HG1 LYS 5 13.658 14.005 20.650
27 HD2 LYS 5 HD2 LYS 5 14.176 16.434 20.315
28 HD3 LYS 5 HD1 LYS 5 12.541 16.682 19.612
29 HE2 LYS 5 HE2 LYS 5 11.465 16.107 21.768
30 HE3 LYS 5 HE1 LYS 5 13.062 15.669 22.485
31 HZ1 LYS 5 HZ1 LYS 5 12.324 18.392 21.489
32 HZ2 LYS 5 HZ2 LYS 5 13.777 17.928 22.213
33 HZ3 LYS 5 HZ3 LYS 5 12.349 17.872 23.106
34 H ARG 6 HN ARG 6 14.951 14.816 15.691
35 HA ARG 6 HA ARG 6 16.108 12.211 15.228
36 HB2 ARG 6 HB2 ARG 6 14.784 14.400 13.591
37 HB3 ARG 6 HB1 ARG 6 15.503 12.967 12.751
38 HG2 ARG 6 HG2 ARG 6 14.087 11.510 13.512
39 HG3 ARG 6 HG1 ARG 6 13.770 12.360 15.015
40 HD2 ARG 6 HD2 ARG 6 12.416 14.219 13.723
41 HD3 ARG 6 HD1 ARG 6 12.770 13.458 12.200
42 HE ARG 6 HE ARG 6 11.318 11.982 14.469
43 HH11 ARG 6 HH11 ARG 6 11.691 12.300 10.960
44 HH12 ARG 6 HH12 ARG 6 10.090 11.788 10.624
45 HH21 ARG 6 HH21 ARG 6 9.185 11.305 14.008
46 HH22 ARG 6 HH22 ARG 6 8.725 11.097 12.342
47 H ASN 7 HN ASN 7 16.827 15.335 13.653
48 HA ASN 7 HA ASN 7 19.547 14.419 13.326
49 HB2 ASN 7 HB2 ASN 7 18.642 17.194 12.432
50 HB3 ASN 7 HB1 ASN 7 19.950 16.158 11.803
51 HD21 ASN 7 HD21 ASN 7 16.555 16.964 11.612
52 HD22 ASN 7 HD22 ASN 7 16.227 15.942 10.248
53 H PHE 8 HN PHE 8 20.708 14.464 15.126
54 HA PHE 8 HA PHE 8 19.965 16.210 17.187
55 HB2 PHE 8 HB2 PHE 8 21.653 15.017 18.567
56 HB3 PHE 8 HB1 PHE 8 20.565 13.927 17.656
57 HD1 PHE 8 HD2 PHE 8 24.046 15.204 17.781
58 HD2 PHE 8 HD1 PHE 8 21.317 12.321 16.201
59 HE1 PHE 8 HE2 PHE 8 25.894 13.929 16.880
60 HE2 PHE 8 HE1 PHE 8 23.145 11.044 15.351
61 HZ PHE 8 HZ PHE 8 25.477 11.838 15.636
62 H LEU 9 HN LEU 9 22.549 16.549 14.893
63 HA LEU 9 HA LEU 9 23.670 18.707 16.478
64 HB2 LEU 9 HB2 LEU 9 24.583 18.314 13.603
65 HB3 LEU 9 HB1 LEU 9 25.378 18.985 15.038
66 HG LEU 9 HG LEU 9 24.914 15.963 14.856
67 HD11 LEU 9 HD11 LEU 9 26.110 16.656 12.810
68 HD12 LEU 9 HD12 LEU 9 27.179 15.809 13.990
69 HD13 LEU 9 HD13 LEU 9 27.287 17.607 13.819
70 HD21 LEU 9 HD21 LEU 9 26.924 15.895 16.206
71 HD22 LEU 9 HD22 LEU 9 25.561 16.660 17.090
72 HD23 LEU 9 HD23 LEU 9 26.919 17.689 16.408
73 H CYS 10 HN CYS 10 20.981 18.640 14.749
74 HA CYS 10 HA CYS 10 21.521 20.647 12.815
75 HB2 CYS 10 HB2 CYS 10 19.764 18.854 12.602
76 HB3 CYS 10 HB1 CYS 10 18.732 19.772 13.717
77 H CYS 11 HN CYS 11 20.736 21.110 16.154
78 HA CYS 11 HA CYS 11 19.091 23.376 15.476
79 HB2 CYS 11 HB2 CYS 11 19.709 21.952 18.126
80 HB3 CYS 11 HB1 CYS 11 18.548 23.286 18.023
Start of MODEL 18
1 H1 SER 1 HT1 SER 1 11.325 24.838 14.109
2 H2 SER 1 HT2 SER 1 11.657 25.500 12.615
3 H3 SER 1 HT3 SER 1 12.001 26.393 13.974
4 HA SER 1 HA SER 1 13.970 25.401 12.916
5 HB2 SER 1 HB2 SER 1 13.393 24.325 15.740
6 HB3 SER 1 HB1 SER 1 15.024 24.445 14.994
7 HG SER 1 HG SER 1 14.483 26.209 16.349
8 H CYS 2 HN CYS 2 15.318 23.451 12.636
9 HA CYS 2 HA CYS 2 13.707 21.362 11.588
10 HB2 CYS 2 HB2 CYS 2 15.943 20.174 11.170
11 HB3 CYS 2 HB1 CYS 2 15.750 21.725 10.363
12 H SER 3 HN SER 3 14.160 19.028 11.964
13 HA SER 3 HA SER 3 13.265 18.485 14.494
14 HB2 SER 3 HB2 SER 3 13.667 15.980 13.684
15 HB3 SER 3 HB1 SER 3 12.594 17.015 12.695
16 HG SER 3 HG SER 3 15.361 16.700 12.224
17 H CYS 4 HN CYS 4 14.433 18.810 16.216
18 HA CYS 4 HA CYS 4 17.230 18.124 16.367
19 HB2 CYS 4 HB2 CYS 4 15.927 20.084 17.453
20 HB3 CYS 4 HB1 CYS 4 15.428 18.921 18.719
21 H LYS 5 HN LYS 5 14.169 16.622 17.292
22 HA LYS 5 HA LYS 5 15.310 14.657 18.926
23 HB2 LYS 5 HB2 LYS 5 12.673 15.033 17.433
24 HB3 LYS 5 HB1 LYS 5 13.103 13.380 17.939
25 HG2 LYS 5 HG2 LYS 5 11.662 14.412 19.548
26 HG3 LYS 5 HG1 LYS 5 13.238 13.959 20.253
27 HD2 LYS 5 HD2 LYS 5 13.926 16.450 19.996
28 HD3 LYS 5 HD1 LYS 5 12.209 16.773 19.572
29 HE2 LYS 5 HE2 LYS 5 11.537 15.738 21.823
30 HE3 LYS 5 HE1 LYS 5 13.288 15.478 22.173
31 HZ1 LYS 5 HZ1 LYS 5 13.501 17.975 21.748
32 HZ2 LYS 5 HZ2 LYS 5 12.784 17.451 23.186
33 HZ3 LYS 5 HZ3 LYS 5 11.825 18.049 21.926
34 H ARG 6 HN ARG 6 14.991 14.792 15.366
35 HA ARG 6 HA ARG 6 16.132 12.131 15.170
36 HB2 ARG 6 HB2 ARG 6 15.314 14.369 13.250
37 HB3 ARG 6 HB1 ARG 6 16.109 12.852 12.644
38 HG2 ARG 6 HG2 ARG 6 14.402 11.529 13.131
39 HG3 ARG 6 HG1 ARG 6 13.733 12.568 14.364
40 HD2 ARG 6 HD2 ARG 6 13.207 14.407 12.548
41 HD3 ARG 6 HD1 ARG 6 13.679 13.349 11.259
42 HE ARG 6 HE ARG 6 11.880 11.680 12.315
43 HH11 ARG 6 HH21 ARG 6 11.272 15.138 11.792
44 HH12 ARG 6 HH22 ARG 6 9.728 15.036 12.563
45 HH21 ARG 6 HH11 ARG 6 9.903 11.716 13.423
46 HH22 ARG 6 HH12 ARG 6 8.912 13.156 13.312
47 H ASN 7 HN ASN 7 17.140 15.161 13.636
48 HA ASN 7 HA ASN 7 19.884 14.315 14.000
49 HB2 ASN 7 HB2 ASN 7 19.185 16.800 12.407
50 HB3 ASN 7 HB1 ASN 7 20.523 15.633 12.172
51 HD21 ASN 7 HD21 ASN 7 19.679 13.274 11.582
52 HD22 ASN 7 HD22 ASN 7 18.344 13.227 10.474
53 H PHE 8 HN PHE 8 20.302 14.732 16.151
54 HA PHE 8 HA PHE 8 19.858 17.157 17.410
55 HB2 PHE 8 HB2 PHE 8 21.623 16.239 19.086
56 HB3 PHE 8 HB1 PHE 8 20.175 15.241 18.777
57 HD1 PHE 8 HD2 PHE 8 23.799 15.503 17.850
58 HD2 PHE 8 HD1 PHE 8 20.281 13.081 18.084
59 HE1 PHE 8 HE2 PHE 8 25.095 13.537 17.312
60 HE2 PHE 8 HE1 PHE 8 21.569 11.152 17.547
61 HZ PHE 8 HZ PHE 8 24.003 11.339 17.117
62 H LEU 9 HN LEU 9 22.047 16.548 15.034
63 HA LEU 9 HA LEU 9 23.925 18.622 15.813
64 HB2 LEU 9 HB2 LEU 9 24.053 17.460 13.010
65 HB3 LEU 9 HB1 LEU 9 25.280 18.113 14.110
66 HG LEU 9 HG LEU 9 24.060 15.357 14.729
67 HD11 LEU 9 HD11 LEU 9 24.820 15.365 12.341
68 HD12 LEU 9 HD12 LEU 9 25.787 14.343 13.490
69 HD13 LEU 9 HD13 LEU 9 26.459 15.911 12.933
70 HD21 LEU 9 HD21 LEU 9 26.156 14.907 15.702
71 HD22 LEU 9 HD22 LEU 9 25.434 16.324 16.534
72 HD23 LEU 9 HD23 LEU 9 26.800 16.549 15.335
73 H CYS 10 HN CYS 10 20.907 18.725 14.656
74 HA CYS 10 HA CYS 10 21.384 20.680 12.547
75 HB2 CYS 10 HB2 CYS 10 19.654 18.788 12.447
76 HB3 CYS 10 HB1 CYS 10 18.654 19.742 13.563
77 H CYS 11 HN CYS 11 20.959 20.818 15.911
78 HA CYS 11 HA CYS 11 18.850 22.694 15.843
79 HB2 CYS 11 HB2 CYS 11 20.432 21.645 18.252
80 HB3 CYS 11 HB1 CYS 11 18.742 22.156 18.328
Start of MODEL 19
1 H1 SER 1 HT1 SER 1 11.762 25.475 14.134
2 H2 SER 1 HT2 SER 1 12.083 25.667 12.482
3 H3 SER 1 HT3 SER 1 12.771 26.694 13.642
4 HA SER 1 HA SER 1 14.519 25.320 13.159
5 HB2 SER 1 HB2 SER 1 13.026 24.022 15.524
6 HB3 SER 1 HB1 SER 1 14.760 23.769 15.169
7 HG SER 1 HG SER 1 15.138 25.529 16.125
8 H CYS 2 HN CYS 2 15.535 23.304 12.584
9 HA CYS 2 HA CYS 2 13.733 21.331 11.507
10 HB2 CYS 2 HB2 CYS 2 15.976 20.134 10.963
11 HB3 CYS 2 HB1 CYS 2 15.598 21.615 10.078
12 H SER 3 HN SER 3 14.403 18.967 11.974
13 HA SER 3 HA SER 3 13.629 18.684 14.643
14 HB2 SER 3 HB2 SER 3 13.554 16.146 13.862
15 HB3 SER 3 HB1 SER 3 12.564 17.335 12.960
16 HG SER 3 HG SER 3 13.549 16.355 11.406
17 H CYS 4 HN CYS 4 14.948 18.851 16.251
18 HA CYS 4 HA CYS 4 17.654 17.804 16.111
19 HB2 CYS 4 HB2 CYS 4 16.769 20.058 17.100
20 HB3 CYS 4 HB1 CYS 4 16.440 19.087 18.575
21 H LYS 5 HN LYS 5 14.575 16.899 17.549
22 HA LYS 5 HA LYS 5 15.564 14.805 19.120
23 HB2 LYS 5 HB2 LYS 5 12.902 15.424 17.737
24 HB3 LYS 5 HB1 LYS 5 13.183 13.769 18.339
25 HG2 LYS 5 HG2 LYS 5 11.910 14.911 19.896
26 HG3 LYS 5 HG1 LYS 5 13.503 14.569 20.632
27 HD2 LYS 5 HD2 LYS 5 14.130 17.026 20.104
28 HD3 LYS 5 HD1 LYS 5 12.443 17.241 19.525
29 HE2 LYS 5 HE2 LYS 5 11.645 16.515 21.879
30 HE3 LYS 5 HE1 LYS 5 13.382 16.544 22.391
31 HZ1 LYS 5 HZ1 LYS 5 13.355 18.890 21.416
32 HZ2 LYS 5 HZ2 LYS 5 12.620 18.640 22.899
33 HZ3 LYS 5 HZ3 LYS 5 11.672 18.798 21.481
34 H ARG 6 HN ARG 6 14.818 14.933 15.635
35 HA ARG 6 HA ARG 6 15.860 12.296 15.216
36 HB2 ARG 6 HB2 ARG 6 14.934 14.646 13.549
37 HB3 ARG 6 HB1 ARG 6 15.719 13.236 12.723
38 HG2 ARG 6 HG2 ARG 6 14.158 11.818 13.142
39 HG3 ARG 6 HG1 ARG 6 13.621 12.567 14.632
40 HD2 ARG 6 HD2 ARG 6 12.285 14.393 13.320
41 HD3 ARG 6 HD1 ARG 6 13.291 14.127 11.920
42 HE ARG 6 HE ARG 6 12.165 11.604 12.295
43 HH11 ARG 6 HH21 ARG 6 10.593 14.772 11.704
44 HH12 ARG 6 HH22 ARG 6 9.625 14.115 10.443
45 HH21 ARG 6 HH11 ARG 6 11.100 10.913 10.604
46 HH22 ARG 6 HH12 ARG 6 10.160 12.006 9.621
47 H ASN 7 HN ASN 7 17.116 14.977 13.382
48 HA ASN 7 HA ASN 7 19.752 13.926 13.904
49 HB2 ASN 7 HB2 ASN 7 19.244 16.281 12.016
50 HB3 ASN 7 HB1 ASN 7 20.675 15.242 12.142
51 HD21 ASN 7 HD21 ASN 7 17.816 15.584 10.387
52 HD22 ASN 7 HD22 ASN 7 17.859 13.977 9.686
53 H PHE 8 HN PHE 8 20.744 14.450 15.761
54 HA PHE 8 HA PHE 8 20.002 16.627 17.254
55 HB2 PHE 8 HB2 PHE 8 21.918 15.917 18.774
56 HB3 PHE 8 HB1 PHE 8 20.716 14.664 18.363
57 HD1 PHE 8 HD1 PHE 8 24.096 15.861 17.070
58 HD2 PHE 8 HD2 PHE 8 21.439 12.607 17.894
59 HE1 PHE 8 HE1 PHE 8 25.782 14.293 16.403
60 HE2 PHE 8 HE2 PHE 8 23.129 11.060 17.229
61 HZ PHE 8 HZ PHE 8 25.346 11.872 16.456
62 H LEU 9 HN LEU 9 22.206 16.606 14.787
63 HA LEU 9 HA LEU 9 23.716 18.880 15.721
64 HB2 LEU 9 HB2 LEU 9 23.672 18.230 12.740
65 HB3 LEU 9 HB1 LEU 9 24.884 18.997 13.784
66 HG LEU 9 HG LEU 9 24.381 15.976 14.021
67 HD11 LEU 9 HD11 LEU 9 26.195 15.648 12.528
68 HD12 LEU 9 HD12 LEU 9 26.362 17.424 12.221
69 HD13 LEU 9 HD13 LEU 9 24.871 16.535 11.665
70 HD21 LEU 9 HD21 LEU 9 26.678 15.934 14.694
71 HD22 LEU 9 HD22 LEU 9 25.704 16.829 15.896
72 HD23 LEU 9 HD23 LEU 9 26.796 17.734 14.726
73 H CYS 10 HN CYS 10 20.633 18.527 14.495
74 HA CYS 10 HA CYS 10 20.684 21.056 13.059
75 HB2 CYS 10 HB2 CYS 10 19.501 18.764 12.368
76 HB3 CYS 10 HB1 CYS 10 18.135 19.502 13.237
77 H CYS 11 HN CYS 11 20.862 21.032 16.073
78 HA CYS 11 HA CYS 11 18.445 22.488 16.763
79 HB2 CYS 11 HB2 CYS 11 21.020 21.809 18.272
80 HB3 CYS 11 HB1 CYS 11 19.952 23.079 18.869
Start of MODEL 20
1 H1 SER 1 HT1 SER 1 12.590 26.529 13.748
2 H2 SER 1 HT2 SER 1 11.600 25.158 13.809
3 H3 SER 1 HT3 SER 1 12.368 25.600 12.373
4 HA SER 1 HA SER 1 14.522 25.175 13.305
5 HB2 SER 1 HB2 SER 1 12.945 24.120 15.731
6 HB3 SER 1 HB1 SER 1 14.719 23.960 15.488
7 HG SER 1 HG SER 1 14.203 25.730 16.787
8 H CYS 2 HN CYS 2 15.520 23.082 12.909
9 HA CYS 2 HA CYS 2 13.709 21.297 11.578
10 HB2 CYS 2 HB2 CYS 2 15.995 20.025 11.172
11 HB3 CYS 2 HB1 CYS 2 15.696 21.551 10.325
12 H SER 3 HN SER 3 14.442 18.795 11.908
13 HA SER 3 HA SER 3 13.202 18.258 14.338
14 HB2 SER 3 HB2 SER 3 13.682 15.768 13.520
15 HB3 SER 3 HB1 SER 3 12.685 16.818 12.464
16 HG SER 3 HG SER 3 14.214 15.857 11.247
17 H CYS 4 HN CYS 4 14.295 18.772 16.114
18 HA CYS 4 HA CYS 4 17.117 18.206 16.331
19 HB2 CYS 4 HB2 CYS 4 15.890 20.276 17.121
20 HB3 CYS 4 HB1 CYS 4 15.140 19.319 18.429
21 H LYS 5 HN LYS 5 14.130 16.742 17.332
22 HA LYS 5 HA LYS 5 15.207 14.859 19.120
23 HB2 LYS 5 HB2 LYS 5 12.789 14.949 17.227
24 HB3 LYS 5 HB1 LYS 5 13.289 13.376 17.903
25 HG2 LYS 5 HG2 LYS 5 11.526 14.211 19.179
26 HG3 LYS 5 HG1 LYS 5 12.997 14.134 20.183
27 HD2 LYS 5 HD2 LYS 5 13.252 16.674 19.798
28 HD3 LYS 5 HD1 LYS 5 11.634 16.631 19.008
29 HE2 LYS 5 HE2 LYS 5 10.652 15.690 21.149
30 HE3 LYS 5 HE1 LYS 5 12.293 15.750 21.915
31 HZ1 LYS 5 HZ1 LYS 5 10.506 17.935 21.092
32 HZ2 LYS 5 HZ2 LYS 5 12.164 18.240 21.254
33 HZ3 LYS 5 HZ3 LYS 5 11.279 17.671 22.582
34 H ARG 6 HN ARG 6 14.912 14.752 15.551
35 HA ARG 6 HA ARG 6 16.217 12.190 15.456
36 HB2 ARG 6 HB2 ARG 6 14.996 14.195 13.514
37 HB3 ARG 6 HB1 ARG 6 15.822 12.722 12.873
38 HG2 ARG 6 HG2 ARG 6 14.368 11.299 13.605
39 HG3 ARG 6 HG1 ARG 6 13.828 12.266 14.967
40 HD2 ARG 6 HD2 ARG 6 12.621 13.952 13.332
41 HD3 ARG 6 HD1 ARG 6 13.202 13.073 11.947
42 HE ARG 6 HE ARG 6 12.004 10.985 13.193
43 HH11 ARG 6 HH11 ARG 6 10.681 14.279 13.646
44 HH12 ARG 6 HH12 ARG 6 9.092 13.660 13.796
45 HH21 ARG 6 HH21 ARG 6 10.014 10.301 13.502
46 HH22 ARG 6 HH22 ARG 6 8.668 11.376 13.721
47 H ASN 7 HN ASN 7 16.913 15.152 13.652
48 HA ASN 7 HA ASN 7 19.699 14.367 13.569
49 HB2 ASN 7 HB2 ASN 7 18.605 16.809 12.092
50 HB3 ASN 7 HB1 ASN 7 20.160 15.965 11.895
51 HD21 ASN 7 HD21 ASN 7 19.995 13.501 11.467
52 HD22 ASN 7 HD22 ASN 7 18.686 12.968 10.456
53 H PHE 8 HN PHE 8 20.581 14.631 15.457
54 HA PHE 8 HA PHE 8 19.914 16.709 17.187
55 HB2 PHE 8 HB2 PHE 8 21.689 15.609 18.673
56 HB3 PHE 8 HB1 PHE 8 20.396 14.527 18.067
57 HD1 PHE 8 HD2 PHE 8 23.963 15.424 17.548
58 HD2 PHE 8 HD1 PHE 8 20.809 12.621 16.865
59 HE1 PHE 8 HE2 PHE 8 25.531 13.883 16.510
60 HE2 PHE 8 HE1 PHE 8 22.354 11.114 15.858
61 HZ PHE 8 HZ PHE 8 24.761 11.714 15.653
62 H LEU 9 HN LEU 9 22.459 16.607 14.819
63 HA LEU 9 HA LEU 9 23.753 18.862 16.117
64 HB2 LEU 9 HB2 LEU 9 24.506 18.196 13.283
65 HB3 LEU 9 HB1 LEU 9 25.371 18.963 14.630
66 HG LEU 9 HG LEU 9 24.826 15.949 14.637
67 HD11 LEU 9 HD11 LEU 9 26.029 16.595 12.554
68 HD12 LEU 9 HD12 LEU 9 27.057 15.688 13.748
69 HD13 LEU 9 HD13 LEU 9 27.259 17.473 13.572
70 HD21 LEU 9 HD21 LEU 9 25.545 16.788 16.854
71 HD22 LEU 9 HD22 LEU 9 26.976 17.609 16.065
72 HD23 LEU 9 HD23 LEU 9 26.779 15.818 15.993
73 H CYS 10 HN CYS 10 20.888 18.737 14.634
74 HA CYS 10 HA CYS 10 21.331 20.833 12.686
75 HB2 CYS 10 HB2 CYS 10 19.699 18.815 12.456
76 HB3 CYS 10 HB1 CYS 10 18.608 19.739 13.496
77 H CYS 11 HN CYS 11 20.812 20.819 15.998
78 HA CYS 11 HA CYS 11 18.679 22.652 16.082
79 HB2 CYS 11 HB2 CYS 11 20.526 21.625 18.318
80 HB3 CYS 11 HB1 CYS 11 18.861 22.163 18.587